ChemLookup

Monday, April 30, 2012

http://ChemLookup.com Compounds

CAS RN: 5832-01-9
CAS Name: 2-(2,5-dimethyl-7-nitro-1-imidazo[1,2-c]imidazolyl)acetic acid
OPENEYE Name: 2-(2,5-dimethyl-7-nitro-imidazo[1,2-c]imidazol-1-yl)acetic acid
IUPAC Name: 2-(2,5-dimethyl-7-nitroimidazo[1,2-c]imidazol-1-yl)acetic acid
SYSTEMATIC NAME: 2-(2,5-dimethyl-7-nitro-imidazo[1,2-c]imidazol-1-yl)ethanoic acid
MOLECULAR FORMULA: C9H10N4O4
MOLECULAR WEIGHT: 238.2001
SMILES: CC1=CN2C(=NC(=C2N1CC(=O)O)[N+](=O)[O-])C
Structure:

CAS RN: 193623-14-2
CAS Name: (4R)-3-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl (4R)-3-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylate
IUPAC Name: ethyl (4R)-3-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl (4R)-3-ethanoyl-6-methyl-2-oxidanylidene-4-phenyl-1,4-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C16H18N2O4
MOLECULAR WEIGHT: 302.32512
SMILES: CCOC(=O)C1=C(NC(=O)N([C@@H]1C2=CC=CC=C2)C(=O)C)C
Structure:

CAS RN: 193623-14-2
CAS Name: (4S)-3-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl (4S)-3-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylate
IUPAC Name: ethyl (4S)-3-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl (4S)-3-ethanoyl-6-methyl-2-oxidanylidene-4-phenyl-1,4-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C16H18N2O4
MOLECULAR WEIGHT: 302.32512
SMILES: CCOC(=O)C1=C(NC(=O)N([C@H]1C2=CC=CC=C2)C(=O)C)C
Structure:

CAS RN: 1496-40-8
CAS Name: 2-(1-piperidinyl)-5-(trifluoromethyl)aniline
OPENEYE Name: 2-(1-piperidyl)-5-(trifluoromethyl)aniline
IUPAC Name: 2-piperidin-1-yl-5-(trifluoromethyl)aniline
SYSTEMATIC NAME: 2-piperidin-1-yl-5-(trifluoromethyl)aniline
MOLECULAR FORMULA: C12H15F3N2
MOLECULAR WEIGHT: 244.25611
SMILES: C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)N
Structure:

CAS RN: 6195-03-5
CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-methyl-2-pyridinyl)-2-propenamide
OPENEYE Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-methyl-2-pyridyl)prop-2-enamide
IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-methylpyridin-2-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-methylpyridin-2-yl)prop-2-enamide
MOLECULAR FORMULA: C16H14N2O3
MOLECULAR WEIGHT: 282.29396
SMILES: CC1=CC(=NC=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3
Structure:

CAS RN: 3726-36-1
CAS Name: 1-(4-fluorophenyl)-3-phenylthiourea
OPENEYE Name: 1-(4-fluorophenyl)-3-phenyl-thiourea
IUPAC Name: 1-(4-fluorophenyl)-3-phenylthiourea
SYSTEMATIC NAME: 1-(4-fluorophenyl)-3-phenyl-thiourea
MOLECULAR FORMULA: C13H11FN2S
MOLECULAR WEIGHT: 246.303243
SMILES: C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)F
Structure:

CAS RN: 5747-82-0
CAS Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-phenylacetamide
OPENEYE Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-phenyl-acetamide
IUPAC Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-phenylacetamide
SYSTEMATIC NAME: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-phenyl-ethanamide
MOLECULAR FORMULA: C21H17N3O
MOLECULAR WEIGHT: 327.37918
SMILES: C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3
Structure:

CAS RN: 215778-63-5
CAS Name: 6-bromo-2-methyl-4-quinolinecarbohydrazide
OPENEYE Name: 6-bromo-2-methyl-quinoline-4-carbohydrazide
IUPAC Name: 6-bromo-2-methylquinoline-4-carbohydrazide
SYSTEMATIC NAME: 6-bromanyl-2-methyl-quinoline-4-carbohydrazide
MOLECULAR FORMULA: C11H10BrN3O
MOLECULAR WEIGHT: 280.1206
SMILES: CC1=NC2=C(C=C(C=C2)Br)C(=C1)C(=O)NN
Structure:

CAS RN: 79448-02-5
CAS Name: 1-(2-furanylmethyl)-3-(2-methoxyphenyl)thiourea
OPENEYE Name: 1-(2-furylmethyl)-3-(2-methoxyphenyl)thiourea
IUPAC Name: 1-(furan-2-ylmethyl)-3-(2-methoxyphenyl)thiourea
SYSTEMATIC NAME: 1-(furan-2-ylmethyl)-3-(2-methoxyphenyl)thiourea
MOLECULAR FORMULA: C13H14N2O2S
MOLECULAR WEIGHT: 262.32746
SMILES: COC1=CC=CC=C1NC(=S)NCC2=CC=CO2
Structure:

CAS RN: 4815-37-6
CAS Name: 2-amino-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-amino-5-methyl-4-phenyl-thiophene-3-carboxylate
IUPAC Name: ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanyl-5-methyl-4-phenyl-thiophene-3-carboxylate
MOLECULAR FORMULA: C14H15NO2S
MOLECULAR WEIGHT: 261.3394
SMILES: CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N
Structure:

CAS RN: 5655-67-4
CAS Name: 1-(2,4-dimethyl-3-pyrazolo[1,5-a]benzimidazolyl)ethanone
OPENEYE Name: 1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)ethanone
IUPAC Name: 1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)ethanone
SYSTEMATIC NAME: 1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)ethanone
MOLECULAR FORMULA: C13H13N3O
MOLECULAR WEIGHT: 227.26182
SMILES: CC1=NN2C3=CC=CC=C3N(C2=C1C(=O)C)C
Structure:

CAS RN: 5799-86-0
CAS Name: 5-[(2,4-dimethoxyphenyl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
OPENEYE Name: 5-[(2,4-dimethoxyphenyl)methylene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione
IUPAC Name: 5-[(2,4-dimethoxyphenyl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
SYSTEMATIC NAME: 5-[(2,4-dimethoxyphenyl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
MOLECULAR FORMULA: C17H20N2O4S
MOLECULAR WEIGHT: 348.4167
SMILES: CCN1C(=O)C(=CC2=C(C=C(C=C2)OC)OC)C(=O)N(C1=S)CC
Structure:

CAS RN: 174561-11-6
CAS Name: 2-[4-[(4-fluorophenyl)methyl]-1-piperazinyl]ethanol
OPENEYE Name: 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]ethanol
IUPAC Name: 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]ethanol
MOLECULAR FORMULA: C13H19FN2O
MOLECULAR WEIGHT: 238.301163
SMILES: C1CN(CCN1CCO)CC2=CC=C(C=C2)F
Structure:

CAS RN: 183673-71-4
CAS Name: 4-amino-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinecarboxylic acid
OPENEYE Name: 4-amino-1-tert-butoxycarbonyl-piperidine-4-carboxylic acid
IUPAC Name: 4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
SYSTEMATIC NAME: 4-azanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
MOLECULAR FORMULA: C11H20N2O4
MOLECULAR WEIGHT: 244.2875
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)N
Structure:

CAS RN: 40553-78-4
CAS Name: 1,2,2,6,6-pentamethyl-4-piperidinamine
OPENEYE Name: 1,2,2,6,6-pentamethylpiperidin-4-amine
IUPAC Name: 1,2,2,6,6-pentamethylpiperidin-4-amine
SYSTEMATIC NAME: 1,2,2,6,6-pentamethylpiperidin-4-amine
MOLECULAR FORMULA: C10H22N2
MOLECULAR WEIGHT: 170.29508
SMILES: CC1(CC(CC(N1C)(C)C)N)C
Structure:

CAS RN: 77-70-3
CAS Name: 1-(5-chloro-2-methylphenyl)piperazine
OPENEYE Name: 1-(5-chloro-2-methyl-phenyl)piperazine
IUPAC Name: 1-(5-chloro-2-methylphenyl)piperazine
SYSTEMATIC NAME: 1-(5-chloranyl-2-methyl-phenyl)piperazine
MOLECULAR FORMULA: C11H15ClN2
MOLECULAR WEIGHT: 210.7032
SMILES: CC1=C(C=C(C=C1)Cl)N2CCNCC2
Structure:

http://ChemLookup.com Compounds

CAS RN: 134937-61-4
CAS Name: 2-(2,5-dimethylphenoxy)-1-(1-pyrrolidinyl)ethanone
OPENEYE Name: 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-yl-ethanone
IUPAC Name: 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-ylethanone
SYSTEMATIC NAME: 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-yl-ethanone
MOLECULAR FORMULA: C14H19NO2
MOLECULAR WEIGHT: 233.30616
SMILES: CC1=CC(=C(C=C1)C)OCC(=O)N2CCCC2
Structure:

CAS RN: 51010-74-3
CAS Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C15H10N2O3
MOLECULAR WEIGHT: 266.2515
SMILES: C1=CC(=CC=C1/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:

CAS RN: 1226-74-0
CAS Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C15H10N2O3
MOLECULAR WEIGHT: 266.2515
SMILES: C1=CC(=CC=C1/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:

CAS RN: 14003-22-6
CAS Name: 1-(4-methoxyphenyl)-2H-tetrazole-5-thione
OPENEYE Name: 1-(4-methoxyphenyl)-2H-tetrazole-5-thione
IUPAC Name: 1-(4-methoxyphenyl)-2H-tetrazole-5-thione
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-2H-1,2,3,4-tetrazole-5-thione
MOLECULAR FORMULA: C8H8N4OS
MOLECULAR WEIGHT: 208.24032
SMILES: COC1=CC=C(C=C1)N2C(=S)N=NN2
Structure:

CAS RN: 5681-27-6
CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(3,4-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H14N2O4
MOLECULAR WEIGHT: 310.30406
SMILES: COC1=C(C=C(C=C1)/C=C(/C#N)\C2=CC=C(C=C2)[N+](=O)[O-])OC
Structure:

CAS RN: 59581-76-9
CAS Name: (2Z)-2-[(4-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
OPENEYE Name: (2Z)-2-[(4-methoxyphenyl)methylene]tetralin-1-one
IUPAC Name: (2Z)-2-[(4-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
SYSTEMATIC NAME: (2Z)-2-[(4-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
MOLECULAR FORMULA: C18H16O2
MOLECULAR WEIGHT: 264.31844
SMILES: COC1=CC=C(C=C1)/C=C\2/CCC3=CC=CC=C3C2=O
Structure:

CAS RN: 5382-68-3
CAS Name: 1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate
IUPAC Name: ethyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate
SYSTEMATIC NAME: ethyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate
MOLECULAR FORMULA: C14H18FNO4S
MOLECULAR WEIGHT: 315.360423
SMILES: CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F
Structure:

CAS RN: 24247-79-8
CAS Name: (2Z)-2-(1-naphthalenylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
OPENEYE Name: (2Z)-2-(1-naphthylmethylene)quinuclidin-3-one
IUPAC Name: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C18H17NO
MOLECULAR WEIGHT: 263.33368
SMILES: C1CN\2CCC1C(=O)/C2=C/C3=CC=CC4=CC=CC=C43
Structure:

CAS RN: 24123-91-9
CAS Name: (2Z)-2-(1-naphthalenylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
OPENEYE Name: (2Z)-2-(1-naphthylmethylene)quinuclidin-3-one
IUPAC Name: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: (2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C18H17NO
MOLECULAR WEIGHT: 263.33368
SMILES: C1CN\2CCC1C(=O)/C2=C/C3=CC=CC4=CC=CC=C43
Structure:

CAS RN: 77362-24-4
CAS Name: (4Z)-4-[(1-acetyl-3-indolyl)methylidene]-2-phenyl-5-oxazolone
OPENEYE Name: (4Z)-4-[(1-acetylindol-3-yl)methylene]-2-phenyl-oxazol-5-one
IUPAC Name: (4Z)-4-[(1-acetylindol-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
SYSTEMATIC NAME: (4Z)-4-[(1-ethanoylindol-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
MOLECULAR FORMULA: C20H14N2O3
MOLECULAR WEIGHT: 330.33676
SMILES: CC(=O)N1C=C(C2=CC=CC=C21)/C=C\3/C(=O)OC(=N3)C4=CC=CC=C4
Structure:

CAS RN: 312290-54-3
CAS Name: 3-(4-tert-butylphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-allyl-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-(4-tert-butylphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-(4-tert-butylphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C15H19N3S
MOLECULAR WEIGHT: 273.39646
SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2CC=C
Structure:

CAS RN: 59787-46-1
CAS Name: [4-[(2-methylphenyl)methyl]-1-piperazinyl]-(4-nitrophenyl)methanone
OPENEYE Name: (4-nitrophenyl)-[4-(o-tolylmethyl)piperazin-1-yl]methanone
IUPAC Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(4-nitrophenyl)methanone
SYSTEMATIC NAME: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C19H21N3O3
MOLECULAR WEIGHT: 339.38834
SMILES: CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:

CAS RN: 58721-01-0
CAS Name: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]-1-piperazinyl]methanone
OPENEYE Name: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone
IUPAC Name: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone
SYSTEMATIC NAME: (3-fluorophenyl)-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C18H18FN3O3
MOLECULAR WEIGHT: 343.352223
SMILES: C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)F
Structure:

CAS RN: 23195-30-4
CAS Name: 3-(2-methoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-allyl-3-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-(2-methoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-(2-methoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C12H13N3OS
MOLECULAR WEIGHT: 247.31612
SMILES: COC1=CC=CC=C1C2=NNC(=S)N2CC=C
Structure:

http://ChemLookup.com Compounds

CAS RN: 36822-11-4
CAS Name: 6-phenyl-2-sulfanylidene-1H-pyrimidin-4-one
OPENEYE Name: 6-phenyl-2-thioxo-1H-pyrimidin-4-one
IUPAC Name: 6-phenyl-2-sulfanylidene-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-phenyl-2-sulfanylidene-1H-pyrimidin-4-one
MOLECULAR FORMULA: C10H8N2OS
MOLECULAR WEIGHT: 204.24832
SMILES: C1=CC=C(C=C1)C2=CC(=O)NC(=S)N2
Structure:

CAS RN: 139705-74-1
CAS Name: 4-(2-imidazo[1,2-a]pyridinyl)aniline
OPENEYE Name: 4-imidazo[1,2-a]pyridin-2-ylaniline
IUPAC Name: 4-imidazo[1,2-a]pyridin-2-ylaniline
SYSTEMATIC NAME: 4-imidazo[1,2-a]pyridin-2-ylaniline
MOLECULAR FORMULA: C13H11N3
MOLECULAR WEIGHT: 209.24654
SMILES: C1=CC2=NC(=CN2C=C1)C3=CC=C(C=C3)N
Structure:

CAS RN: 53759-83-4
CAS Name: (5E)-5-[(4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
OPENEYE Name: (5E)-5-[(4-methoxyphenyl)methylene]imidazolidine-2,4-dione
IUPAC Name: (5E)-5-[(4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
SYSTEMATIC NAME: (5E)-5-[(4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
MOLECULAR FORMULA: C11H10N2O3
MOLECULAR WEIGHT: 218.2087
SMILES: COC1=CC=C(C=C1)/C=C/2\C(=O)NC(=O)N2
Structure:

CAS RN: 5349-42-8
CAS Name: (5E)-5-[(4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
OPENEYE Name: (5E)-5-[(4-methoxyphenyl)methylene]imidazolidine-2,4-dione
IUPAC Name: (5E)-5-[(4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
SYSTEMATIC NAME: (5E)-5-[(4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
MOLECULAR FORMULA: C11H10N2O3
MOLECULAR WEIGHT: 218.2087
SMILES: COC1=CC=C(C=C1)/C=C/2\C(=O)NC(=O)N2
Structure:

CAS RN: 175204-21-4
CAS Name: 2,1,3-benzothiadiazole-5-carboxylic acid methyl ester
OPENEYE Name: methyl 2,1,3-benzothiadiazole-5-carboxylate
IUPAC Name: methyl 2,1,3-benzothiadiazole-5-carboxylate
SYSTEMATIC NAME: methyl 2,1,3-benzothiadiazole-5-carboxylate
MOLECULAR FORMULA: C8H6N2O2S
MOLECULAR WEIGHT: 194.21044
SMILES: COC(=O)C1=CC2=NSN=C2C=C1
Structure:

CAS RN: 38942-57-3
CAS Name: 4-cyclohexyl-3-phenyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-cyclohexyl-3-phenyl-1H-1,2,4-triazole-5-thione
IUPAC Name: 4-cyclohexyl-3-phenyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 4-cyclohexyl-3-phenyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C14H17N3S
MOLECULAR WEIGHT: 259.36988
SMILES: C1CCC(CC1)N2C(=NNC2=S)C3=CC=CC=C3
Structure:

CAS RN: 112193-41-6
CAS Name: 5-bromo-3-pyridinecarbohydrazide
OPENEYE Name: 5-bromopyridine-3-carbohydrazide
IUPAC Name: 5-bromopyridine-3-carbohydrazide
SYSTEMATIC NAME: 5-bromanylpyridine-3-carbohydrazide
MOLECULAR FORMULA: C6H6BrN3O
MOLECULAR WEIGHT: 216.03534
SMILES: C1=C(C=NC=C1Br)C(=O)NN
Structure:

CAS RN: 37014-08-7
CAS Name: (3-methoxyphenyl)thiourea
OPENEYE Name: (3-methoxyphenyl)thiourea
IUPAC Name: (3-methoxyphenyl)thiourea
SYSTEMATIC NAME: 1-(3-methoxyphenyl)thiourea
MOLECULAR FORMULA: C8H10N2OS
MOLECULAR WEIGHT: 182.2428
SMILES: COC1=CC=CC(=C1)NC(=S)N
Structure:

CAS RN: 37247-99-7
CAS Name: (3-methoxyphenyl)thiourea
OPENEYE Name: (3-methoxyphenyl)thiourea
IUPAC Name: (3-methoxyphenyl)thiourea
SYSTEMATIC NAME: 1-(3-methoxyphenyl)thiourea
MOLECULAR FORMULA: C8H10N2OS
MOLECULAR WEIGHT: 182.2428
SMILES: COC1=CC=CC(=C1)NC(=S)N
Structure:

CAS RN: 31330-51-5
CAS Name: (E)-2-cyano-3-thiophen-2-yl-2-propenoic acid ethyl ester
OPENEYE Name: ethyl (E)-2-cyano-3-(2-thienyl)prop-2-enoate
IUPAC Name: ethyl (E)-2-cyano-3-thiophen-2-ylprop-2-enoate
SYSTEMATIC NAME: ethyl (E)-2-cyano-3-thiophen-2-yl-prop-2-enoate
MOLECULAR FORMULA: C10H9NO2S
MOLECULAR WEIGHT: 207.24896
SMILES: CCOC(=O)/C(=C/C1=CC=CS1)/C#N
Structure:

CAS RN: 137438-23-4
CAS Name: (7R)-4-chloro-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
OPENEYE Name: (7R)-4-chloro-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine
IUPAC Name: (7R)-4-chloro-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
SYSTEMATIC NAME: (7R)-4-chloranyl-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
MOLECULAR FORMULA: C11H11ClN2S
MOLECULAR WEIGHT: 238.73644
SMILES: C[C@@H]1CCC2=C(C1)SC3=C2C(=NC=N3)Cl
Structure:

CAS RN: 101622-73-5
CAS Name: N-(1,3-benzothiazol-2-yl)-2-hydroxybenzamide
OPENEYE Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-benzamide
IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-hydroxybenzamide
SYSTEMATIC NAME: N-(1,3-benzothiazol-2-yl)-2-oxidanyl-benzamide
MOLECULAR FORMULA: C14H10N2O2S
MOLECULAR WEIGHT: 270.3064
SMILES: C1=CC=C(C(=C1)C(=O)NC2=NC3=CC=CC=C3S2)O
Structure:

CAS RN: 137438-23-4
CAS Name: (7S)-4-chloro-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
OPENEYE Name: (7S)-4-chloro-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine
IUPAC Name: (7S)-4-chloro-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
SYSTEMATIC NAME: (7S)-4-chloranyl-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
MOLECULAR FORMULA: C11H11ClN2S
MOLECULAR WEIGHT: 238.73644
SMILES: C[C@H]1CCC2=C(C1)SC3=C2C(=NC=N3)Cl
Structure:

CAS RN: 168837-18-1
CAS Name: 6-chloro-2-phenylimidazo[1,2-a]pyridine
OPENEYE Name: 6-chloro-2-phenyl-imidazo[1,2-a]pyridine
IUPAC Name: 6-chloro-2-phenylimidazo[1,2-a]pyridine
SYSTEMATIC NAME: 6-chloranyl-2-phenyl-imidazo[1,2-a]pyridine
MOLECULAR FORMULA: C13H9ClN2
MOLECULAR WEIGHT: 228.67696
SMILES: C1=CC=C(C=C1)C2=CN3C=C(C=CC3=N2)Cl
Structure:

http://ChemLookup.com Compounds

CAS RN: 3179-10-0
CAS Name: 1-methoxy-4-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1-methoxy-4-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1-methoxy-4-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1-methoxy-4-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C9H9NO3
MOLECULAR WEIGHT: 179.17266
SMILES: COC1=CC=C(C=C1)/C=C/[N+](=O)[O-]
Structure:

CAS RN: 19768-75-3
CAS Name: 4-[(E)-2-carboxyethenyl]benzoic acid
OPENEYE Name: 4-[(E)-2-carboxyvinyl]benzoic acid
IUPAC Name: 4-[(E)-2-carboxyethenyl]benzoic acid
SYSTEMATIC NAME: 4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]benzoic acid
MOLECULAR FORMULA: C10H8O4
MOLECULAR WEIGHT: 192.16812
SMILES: C1=CC(=CC=C1/C=C/C(=O)O)C(=O)O
Structure:

CAS RN: 118399-28-3
CAS Name: N-[(3R)-5-oxo-3-oxolanyl]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[(3R)-5-oxotetrahydrofuran-3-yl]carbamate
IUPAC Name: benzyl N-[(3R)-5-oxooxolan-3-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[(3R)-5-oxidanylideneoxolan-3-yl]carbamate
MOLECULAR FORMULA: C12H13NO4
MOLECULAR WEIGHT: 235.23592
SMILES: C1[C@H](COC1=O)NC(=O)OCC2=CC=CC=C2
Structure:

CAS RN: 7277-87-4
CAS Name: 2-[4-(trifluoromethoxy)phenoxy]acetic acid
OPENEYE Name: 2-[4-(trifluoromethoxy)phenoxy]acetic acid
IUPAC Name: 2-[4-(trifluoromethoxy)phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-(trifluoromethyloxy)phenoxy]ethanoic acid
MOLECULAR FORMULA: C9H7F3O4
MOLECULAR WEIGHT: 236.14469
SMILES: C1=CC(=CC=C1OCC(=O)O)OC(F)(F)F
Structure:

CAS RN: 20146-25-2
CAS Name: 2-(2-furanyl)-4-quinolinecarboxylic acid
OPENEYE Name: 2-(2-furyl)quinoline-4-carboxylic acid
IUPAC Name: 2-(furan-2-yl)quinoline-4-carboxylic acid
SYSTEMATIC NAME: 2-(furan-2-yl)quinoline-4-carboxylic acid
MOLECULAR FORMULA: C14H9NO3
MOLECULAR WEIGHT: 239.22616
SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)O
Structure:

CAS RN: 119767-00-9
CAS Name: (2R)-2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
OPENEYE Name: (2R)-2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
IUPAC Name: (2R)-2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
SYSTEMATIC NAME: (2R)-1,2-bis(4-methoxyphenyl)-2-oxidanyl-ethanone
MOLECULAR FORMULA: C16H16O4
MOLECULAR WEIGHT: 272.29584
SMILES: COC1=CC=C(C=C1)[C@H](C(=O)C2=CC=C(C=C2)OC)O
Structure:

CAS RN: 119-76-6
CAS Name: (2S)-2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
OPENEYE Name: (2S)-2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
IUPAC Name: (2S)-2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
SYSTEMATIC NAME: (2S)-1,2-bis(4-methoxyphenyl)-2-oxidanyl-ethanone
MOLECULAR FORMULA: C16H16O4
MOLECULAR WEIGHT: 272.29584
SMILES: COC1=CC=C(C=C1)[C@@H](C(=O)C2=CC=C(C=C2)OC)O
Structure:

CAS RN: 38795-19-6
CAS Name: (E)-3-(2,5-dimethoxyphenyl)-2-propenoic acid
OPENEYE Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
MOLECULAR FORMULA: C11H12O4
MOLECULAR WEIGHT: 208.21058
SMILES: COC1=CC(=C(C=C1)OC)/C=C/C(=O)O
Structure:

CAS RN: 10538-51-9
CAS Name: (E)-3-(2,5-dimethoxyphenyl)-2-propenoic acid
OPENEYE Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
MOLECULAR FORMULA: C11H12O4
MOLECULAR WEIGHT: 208.21058
SMILES: COC1=CC(=C(C=C1)OC)/C=C/C(=O)O
Structure:

CAS RN: 84-39-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H17NO4
MOLECULAR WEIGHT: 323.34258
SMILES: C1CN2CC3=C(C[C@@H]2C4=CC5=C(C=C41)OCO5)C=CC6=C3OCO6
Structure:

CAS RN: 38970-50-2
CAS Name: 4-hydroxybenzoic acid [(1R,3S,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester
OPENEYE Name: [(1R,2S,4R)-1,7,7-trimethylnorbornan-2-yl] 4-hydroxybenzoate
IUPAC Name: [(1R,3S,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 4-hydroxybenzoate
SYSTEMATIC NAME: [(1R,3S,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 4-oxidanylbenzoate
MOLECULAR FORMULA: C17H22O3
MOLECULAR WEIGHT: 274.35478
SMILES: C[C@@]12CC[C@@H](C1(C)C)C[C@@H]2OC(=O)C3=CC=C(C=C3)O
Structure:

CAS RN: 36361-79-2
CAS Name: 6-methyl-5-(phenylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one
OPENEYE Name: 5-benzyl-6-methyl-2-thioxo-1H-pyrimidin-4-one
IUPAC Name: 5-benzyl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-methyl-5-(phenylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one
MOLECULAR FORMULA: C12H12N2OS
MOLECULAR WEIGHT: 232.30148
SMILES: CC1=C(C(=O)NC(=S)N1)CC2=CC=CC=C2
Structure:

CAS RN: 284680-44-0
CAS Name: 6-methyl-2-(1-pyrrolidinyl)-1H-pyrimidin-4-one
OPENEYE Name: 6-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-4-one
IUPAC Name: 6-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-4-one
MOLECULAR FORMULA: C9H13N3O
MOLECULAR WEIGHT: 179.21902
SMILES: CC1=CC(=O)N=C(N1)N2CCCC2
Structure:

CAS RN: 68141-14-0
CAS Name: (5Z)-5-phenacylideneimidazolidine-2,4-dione
OPENEYE Name: (5Z)-5-phenacylideneimidazolidine-2,4-dione
IUPAC Name: (5Z)-5-phenacylideneimidazolidine-2,4-dione
SYSTEMATIC NAME: (5Z)-5-phenacylideneimidazolidine-2,4-dione
MOLECULAR FORMULA: C11H8N2O3
MOLECULAR WEIGHT: 216.19282
SMILES: C1=CC=C(C=C1)C(=O)/C=C\2/C(=O)NC(=O)N2
Structure:

CAS RN: 102613-14-9
CAS Name: 6-methyl-5-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one
OPENEYE Name: 5-allyl-6-methyl-2-thioxo-1H-pyrimidin-4-one
IUPAC Name: 6-methyl-5-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-methyl-5-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one
MOLECULAR FORMULA: C8H10N2OS
MOLECULAR WEIGHT: 182.2428
SMILES: CC1=C(C(=O)NC(=S)N1)CC=C
Structure: