CAS RN: 5731-91-9
CAS Name: 4-acetamido-N-(3-pyridinyl)benzamide
OPENEYE Name: 4-acetamido-N-(3-pyridyl)benzamide
IUPAC Name: 4-acetamido-N-pyridin-3-ylbenzamide
SYSTEMATIC NAME: 4-acetamido-N-pyridin-3-yl-benzamide
MOLECULAR FORMULA: C14H13N3O2
MOLECULAR WEIGHT: 255.27192
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)NC2=CN=CC=C2
Structure:
CAS RN: 88045-98-1
CAS Name: 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC Name: diethyl 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SYSTEMATIC NAME: diethyl 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C17H23NO6
MOLECULAR WEIGHT: 337.36762
SMILES: CCOC(=O)C1=C(NC(=C(C1C2=COCCO2)C(=O)OCC)C)C
Structure:
CAS RN: 5367-54-4
CAS Name: 1-(2-methoxy-5-methylphenyl)sulfonyl-4-(phenylmethyl)piperazine
OPENEYE Name: 1-benzyl-4-(2-methoxy-5-methyl-phenyl)sulfonyl-piperazine
IUPAC Name: 1-benzyl-4-(2-methoxy-5-methylphenyl)sulfonylpiperazine
SYSTEMATIC NAME: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-(phenylmethyl)piperazine
MOLECULAR FORMULA: C19H24N2O3S
MOLECULAR WEIGHT: 360.47046
SMILES: CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3
Structure:
CAS RN: 130604-31-8
CAS Name: 4-(4-ethoxyphenyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione
OPENEYE Name: 4-(4-ethoxyphenyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione
IUPAC Name: 4-(4-ethoxyphenyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione
SYSTEMATIC NAME: 4-(4-ethoxyphenyl)-1,2,5,7-tetrahydro-1,4,7-benzotriazonine-3,6-dione
MOLECULAR FORMULA: C18H19N3O3
MOLECULAR WEIGHT: 325.36176
SMILES: CCOC1=CC=C(C=C1)N2CC(=O)NC3=CC=CC=C3NCC2=O
Structure:
CAS RN: 49615-96-5
CAS Name: 1-(3-amino-2-benzofuranyl)ethanone
OPENEYE Name: 1-(3-aminobenzofuran-2-yl)ethanone
IUPAC Name: 1-(3-amino-1-benzofuran-2-yl)ethanone
SYSTEMATIC NAME: 1-(3-azanyl-1-benzofuran-2-yl)ethanone
MOLECULAR FORMULA: C10H9NO2
MOLECULAR WEIGHT: 175.18396
SMILES: CC(=O)C1=C(C2=CC=CC=C2O1)N
Structure:
CAS RN: 890596-67-5
CAS Name: 3-(4-acetyl-3,5-dimethyl-1-pyrazolyl)propanoic acid
OPENEYE Name: 3-(4-acetyl-3,5-dimethyl-pyrazol-1-yl)propanoic acid
IUPAC Name: 3-(4-acetyl-3,5-dimethylpyrazol-1-yl)propanoic acid
SYSTEMATIC NAME: 3-(4-ethanoyl-3,5-dimethyl-pyrazol-1-yl)propanoic acid
MOLECULAR FORMULA: C10H14N2O3
MOLECULAR WEIGHT: 210.22976
SMILES: CC1=C(C(=NN1CCC(=O)O)C)C(=O)C
Structure:
CAS RN: 435342-03-3
CAS Name: 5-tert-butyl-2-(1-piperidinylmethyl)-3-furancarboxylic acid
OPENEYE Name: 5-tert-butyl-2-(1-piperidylmethyl)furan-3-carboxylic acid
IUPAC Name: 5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid
SYSTEMATIC NAME: 5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid
MOLECULAR FORMULA: C15H23NO3
MOLECULAR WEIGHT: 265.34802
SMILES: CC(C)(C)C1=CC(=C(O1)CN2CCCCC2)C(=O)O
Structure:
CAS RN: 5021-59-0
CAS Name: N-(1,3-benzothiazol-2-yl)-N-methylcarbamic acid methyl ester
OPENEYE Name: methyl N-(1,3-benzothiazol-2-yl)-N-methyl-carbamate
IUPAC Name: methyl N-(1,3-benzothiazol-2-yl)-N-methylcarbamate
SYSTEMATIC NAME: methyl N-(1,3-benzothiazol-2-yl)-N-methyl-carbamate
MOLECULAR FORMULA: C10H10N2O2S
MOLECULAR WEIGHT: 222.2636
SMILES: CN(C1=NC2=CC=CC=C2S1)C(=O)OC
Structure:
CAS RN: 301353-36-6
CAS Name: 5-(1-piperidinylmethyl)-2-furancarboxylic acid
OPENEYE Name: 5-(1-piperidylmethyl)furan-2-carboxylic acid
IUPAC Name: 5-(piperidin-1-ylmethyl)furan-2-carboxylic acid
SYSTEMATIC NAME: 5-(piperidin-1-ylmethyl)furan-2-carboxylic acid
MOLECULAR FORMULA: C11H15NO3
MOLECULAR WEIGHT: 209.2417
SMILES: C1CCN(CC1)CC2=CC=C(O2)C(=O)O
Structure:
CAS RN: 257862-97-8
CAS Name: 1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]-2-propanone
OPENEYE Name: 1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-one
IUPAC Name: 1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-one
SYSTEMATIC NAME: 1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-one
MOLECULAR FORMULA: C6H9N3OS
MOLECULAR WEIGHT: 171.22016
SMILES: CC(=O)CC1=NSC(=N1)NC
Structure:
CAS RN: 100596-38-1
CAS Name: 5-(2-amino-4-methoxycarbonylphenoxy)benzene-1,3-dicarboxylic acid dimethyl ester
OPENEYE Name: dimethyl 5-(2-amino-4-methoxycarbonyl-phenoxy)benzene-1,3-dicarboxylate
IUPAC Name: dimethyl 5-(2-amino-4-methoxycarbonylphenoxy)benzene-1,3-dicarboxylate
SYSTEMATIC NAME: dimethyl 5-(2-azanyl-4-methoxycarbonyl-phenoxy)benzene-1,3-dicarboxylate
MOLECULAR FORMULA: C18H17NO7
MOLECULAR WEIGHT: 359.33008
SMILES: COC(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)N
Structure:
CAS RN: 531544-17-9
CAS Name: 2-(3-cyano-2-methyl-1-indolyl)acetic acid
OPENEYE Name: 2-(3-cyano-2-methyl-indol-1-yl)acetic acid
IUPAC Name: 2-(3-cyano-2-methylindol-1-yl)acetic acid
SYSTEMATIC NAME: 2-(3-cyano-2-methyl-indol-1-yl)ethanoic acid
MOLECULAR FORMULA: C12H10N2O2
MOLECULAR WEIGHT: 214.22
SMILES: CC1=C(C2=CC=CC=C2N1CC(=O)O)C#N
Structure:
CAS RN: 132304-38-2
CAS Name: 2-(4-morpholinyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
OPENEYE Name: 2-morpholino-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
IUPAC Name: 2-morpholin-4-yl-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-morpholin-4-yl-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C11H18N4O2S
MOLECULAR WEIGHT: 270.35122
SMILES: CCCC1=NN=C(S1)NC(=O)CN2CCOCC2
Structure:
CAS RN: 15912-55-7
CAS Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
IUPAC Name: ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
SYSTEMATIC NAME: ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
MOLECULAR FORMULA: C12H15NO2
MOLECULAR WEIGHT: 205.253
SMILES: CCOC(=O)C1CC2=CC=CC=C2CN1
Structure:
CAS RN: 41234-43-9
CAS Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
IUPAC Name: ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
SYSTEMATIC NAME: ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
MOLECULAR FORMULA: C12H15NO2
MOLECULAR WEIGHT: 205.253
SMILES: CCOC(=O)C1CC2=CC=CC=C2CN1
Structure:
CAS RN: 37711-29-8
CAS Name: N-(10H-phenothiazin-2-yl)carbamic acid ethyl ester
OPENEYE Name: ethyl N-(10H-phenothiazin-2-yl)carbamate
IUPAC Name: ethyl N-(10H-phenothiazin-2-yl)carbamate
SYSTEMATIC NAME: ethyl N-(10H-phenothiazin-2-yl)carbamate
MOLECULAR FORMULA: C15H14N2O2S
MOLECULAR WEIGHT: 286.34886
SMILES: CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2
Structure:
CAS RN: 64179-19-7
CAS Name: 3-(1,3-benzodioxol-5-ylamino)-3H-isobenzofuran-1-one
OPENEYE Name: 3-(1,3-benzodioxol-5-ylamino)-3H-isobenzofuran-1-one
IUPAC Name: 3-(1,3-benzodioxol-5-ylamino)-3H-2-benzofuran-1-one
SYSTEMATIC NAME: 3-(1,3-benzodioxol-5-ylamino)-3H-2-benzofuran-1-one
MOLECULAR FORMULA: C15H11NO4
MOLECULAR WEIGHT: 269.25214
SMILES: C1OC2=C(O1)C=C(C=C2)NC3C4=CC=CC=C4C(=O)O3
Structure:
CAS RN: 5486-26-0
CAS Name: 5-oxo-4-(2-oxo-2-phenacyloxyethyl)-3-oxazolidinecarboxylic acid (phenylmethyl) ester
OPENEYE Name: benzyl 5-oxo-4-(2-oxo-2-phenacyloxy-ethyl)oxazolidine-3-carboxylate
IUPAC Name: benzyl 5-oxo-4-(2-oxo-2-phenacyloxyethyl)-1,3-oxazolidine-3-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 5-oxidanylidene-4-(2-oxidanylidene-2-phenacyloxy-ethyl)-1,3-oxazolidine-3-carboxylate
MOLECULAR FORMULA: C21H19NO7
MOLECULAR WEIGHT: 397.37806
SMILES: C1N(C(C(=O)O1)CC(=O)OCC(=O)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3
Structure:
CAS RN: 6215-48-1
CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-3-(2,3,5-trimethyl-1-indolyl)-2-propanol
OPENEYE Name: 1-(3,5-dimethylpyrazol-1-yl)-3-(2,3,5-trimethylindol-1-yl)propan-2-ol
IUPAC Name: 1-(3,5-dimethylpyrazol-1-yl)-3-(2,3,5-trimethylindol-1-yl)propan-2-ol
SYSTEMATIC NAME: 1-(3,5-dimethylpyrazol-1-yl)-3-(2,3,5-trimethylindol-1-yl)propan-2-ol
MOLECULAR FORMULA: C19H25N3O
MOLECULAR WEIGHT: 311.4213
SMILES: CC1=CC2=C(C=C1)N(C(=C2C)C)CC(CN3C(=CC(=N3)C)C)O
Structure:
CAS RN: 5173-98-8
CAS Name: N-(3-bicyclo[2.2.1]heptanyl)-2-[5-(4-methylphenyl)-2-tetrazolyl]acetamide
OPENEYE Name: N-norbornan-2-yl-2-[5-(p-tolyl)tetrazol-2-yl]acetamide
IUPAC Name: N-(3-bicyclo[2.2.1]heptanyl)-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamide
SYSTEMATIC NAME: N-(3-bicyclo[2.2.1]heptanyl)-2-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
MOLECULAR FORMULA: C17H21N5O
MOLECULAR WEIGHT: 311.38154
SMILES: CC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NC3CC4CCC3C4
Structure:
CAS RN: 6371-22-8
CAS Name: N-(2-furanylmethyl)-2,2,3,3-tetramethyl-1-cyclopropanecarboxamide
OPENEYE Name: N-(2-furylmethyl)-2,2,3,3-tetramethyl-cyclopropanecarboxamide
IUPAC Name: N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-2,2,3,3-tetramethyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C13H19NO2
MOLECULAR WEIGHT: 221.29546
SMILES: CC1(C(C1(C)C)C(=O)NCC2=CC=CO2)C
Structure:
CAS RN: 73889-60-8
CAS Name: 3-[diethylamino(oxo)methyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid
OPENEYE Name: 3-(diethylcarbamoyl)-1,2,2-trimethyl-cyclopentanecarboxylic acid
IUPAC Name: 3-(diethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
SYSTEMATIC NAME: 3-(diethylcarbamoyl)-1,2,2-trimethyl-cyclopentane-1-carboxylic acid
MOLECULAR FORMULA: C14H25NO3
MOLECULAR WEIGHT: 255.3532
SMILES: CCN(CC)C(=O)C1CCC(C1(C)C)(C)C(=O)O
Structure:
CAS RN: 6037-22-5
CAS Name: 1-[(4-chlorophenyl)methyl]-4-(4-methoxyphenyl)sulfonylpiperazine
OPENEYE Name: 1-[(4-chlorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine
IUPAC Name: 1-[(4-chlorophenyl)methyl]-4-(4-methoxyphenyl)sulfonylpiperazine
SYSTEMATIC NAME: 1-[(4-chlorophenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine
MOLECULAR FORMULA: C18H21ClN2O3S
MOLECULAR WEIGHT: 380.88894
SMILES: COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl
Structure:
CAS RN: 64686-81-3
CAS Name: 4-amino-3-ethyl-2-sulfanylidene-5-thiazolecarboxamide
OPENEYE Name: 4-amino-3-ethyl-2-thioxo-thiazole-5-carboxamide
IUPAC Name: 4-amino-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxamide
SYSTEMATIC NAME: 4-azanyl-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxamide
MOLECULAR FORMULA: C6H9N3OS2
MOLECULAR WEIGHT: 203.28516
SMILES: CCN1C(=C(SC1=S)C(=O)N)N
Structure:
CAS RN: 355382-44-4
CAS Name: 1-methoxy-N-[(2-methylphenyl)methyl]-2-propanamine
OPENEYE Name: 1-methoxy-N-(o-tolylmethyl)propan-2-amine
IUPAC Name: 1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine
SYSTEMATIC NAME: 1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine
MOLECULAR FORMULA: C12H19NO
MOLECULAR WEIGHT: 193.28536
SMILES: CC1=CC=CC=C1CNC(C)COC
Structure:
No comments:
Post a Comment