CAS RN: 5819-30-7
CAS Name: 2-(4-methoxy-1-naphthalenyl)-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
OPENEYE Name: 2-(4-methoxy-1-naphthyl)-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
IUPAC Name: 2-(4-methoxynaphthalen-1-yl)-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
SYSTEMATIC NAME: 2-(4-methoxynaphthalen-1-yl)-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
MOLECULAR FORMULA: C19H16N2OS
MOLECULAR WEIGHT: 320.40814
SMILES: COC1=CC=C(C2=CC=CC=C21)C3NN=C(S3)C4=CC=CC=C4
Structure:
CAS RN: 5816-56-8
CAS Name: 5-(1-methyl-2-benzimidazolyl)-2-thiophenesulfonic acid
OPENEYE Name: 5-(1-methylbenzimidazol-2-yl)thiophene-2-sulfonic acid
IUPAC Name: 5-(1-methylbenzimidazol-2-yl)thiophene-2-sulfonic acid
SYSTEMATIC NAME: 5-(1-methylbenzimidazol-2-yl)thiophene-2-sulfonic acid
MOLECULAR FORMULA: C12H10N2O3S2
MOLECULAR WEIGHT: 294.3494
SMILES: CN1C2=CC=CC=C2N=C1C3=CC=C(S3)S(=O)(=O)O
Structure:
CAS RN: 5815-93-0
CAS Name: 5-(4-chlorophenyl)-N-(2-methoxyethyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide
OPENEYE Name: 5-(4-chlorophenyl)-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
IUPAC Name: 5-(4-chlorophenyl)-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SYSTEMATIC NAME: 5-(4-chlorophenyl)-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
MOLECULAR FORMULA: C17H14ClF3N4O2
MOLECULAR WEIGHT: 398.76687
SMILES: COCCNC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=C(C=C3)Cl)C(F)(F)F
Structure:
CAS RN: 5815-87-2
CAS Name: (2Z)-2-(2,2,6-trimethyl-3-sulfanylidene-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylic acid ethyl ester
OPENEYE Name: ethyl (2Z)-2-(2,2,6-trimethyl-3-thioxo-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylate
IUPAC Name: ethyl (2Z)-2-(2,2,6-trimethyl-3-sulfanylidene-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylate
SYSTEMATIC NAME: ethyl (2Z)-2-(2,2,6-trimethyl-3-sulfanylidene-1H-quinolin-4-ylidene)-1,3-dithiole-4-carboxylate
MOLECULAR FORMULA: C18H19NO2S3
MOLECULAR WEIGHT: 377.54396
SMILES: CCOC(=O)C1=CS/C(=C/2\C3=C(C=CC(=C3)C)NC(C2=S)(C)C)/S1
Structure:
CAS RN: 5814-90-4
CAS Name: N-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-5-nitrobenzamide
OPENEYE Name: N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-5-nitro-benzamide
IUPAC Name: N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-5-nitrobenzamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-5-nitro-benzamide
MOLECULAR FORMULA: C19H22N4O4
MOLECULAR WEIGHT: 370.40238
SMILES: CN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)OC
Structure:
CAS RN: 5814-87-9
CAS Name: 2-(3,4-dimethoxyphenyl)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazole
OPENEYE Name: 2-(3,4-dimethoxyphenyl)-5-(p-tolyl)-2,3-dihydro-1,3,4-thiadiazole
IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazole
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazole
MOLECULAR FORMULA: C17H18N2O2S
MOLECULAR WEIGHT: 314.40202
SMILES: CC1=CC=C(C=C1)C2=NNC(S2)C3=CC(=C(C=C3)OC)OC
Structure:
CAS RN: 5814-58-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H16N2O2
MOLECULAR WEIGHT: 304.34254
SMILES: CC1=C2C=CC=C(C2=NC=C1)N3C(=O)C4C5CC(C4C3=O)C=C5
Structure:
CAS RN: 5814-00-6
CAS Name: (Z)-2-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-(2,3-dimethylanilino)-2-propenenitrile
OPENEYE Name: (Z)-2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-(2,3-dimethylanilino)prop-2-enenitrile
IUPAC Name: (Z)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(2,3-dimethylanilino)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2,3-dimethylphenyl)amino]prop-2-enenitrile
MOLECULAR FORMULA: C22H21N3O2S
MOLECULAR WEIGHT: 391.48604
SMILES: CC1=C(C(=CC=C1)N/C=C(/C#N)\C2=NC(=CS2)C3=CC(=C(C=C3)OC)OC)C
Structure:
CAS RN: 5813-97-8
CAS Name: (Z)-3-(3,5-dichloroanilino)-2-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-propenenitrile
OPENEYE Name: (Z)-3-(3,5-dichloroanilino)-2-[4-(2-oxochromen-3-yl)thiazol-2-yl]prop-2-enenitrile
IUPAC Name: (Z)-3-(3,5-dichloroanilino)-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-[[3,5-bis(chloranyl)phenyl]amino]-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
MOLECULAR FORMULA: C21H11Cl2N3O2S
MOLECULAR WEIGHT: 440.30194
SMILES: C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)/C(=C\NC4=CC(=CC(=C4)Cl)Cl)/C#N
Structure:
CAS RN: 5813-75-2
CAS Name: 2,6-ditert-butyl-4-(2,5-dimethoxyphenyl)imino-1-cyclohexa-2,5-dienone
OPENEYE Name: 2,6-ditert-butyl-4-(2,5-dimethoxyphenyl)imino-cyclohexa-2,5-dien-1-one
IUPAC Name: 2,6-ditert-butyl-4-(2,5-dimethoxyphenyl)iminocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-ditert-butyl-4-(2,5-dimethoxyphenyl)imino-cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C22H29NO3
MOLECULAR WEIGHT: 355.47056
SMILES: CC(C)(C)C1=CC(=NC2=C(C=CC(=C2)OC)OC)C=C(C1=O)C(C)(C)C
Structure:
CAS RN: 5813-68-3
CAS Name: 4-[5-(3-methyl-1-piperazinyl)-2-nitrophenyl]morpholine hydrochloride
OPENEYE Name: 4-[5-(3-methylpiperazin-1-yl)-2-nitro-phenyl]morpholine hydrochloride
IUPAC Name: 4-[5-(3-methylpiperazin-1-yl)-2-nitrophenyl]morpholine hydrochloride
SYSTEMATIC NAME: 4-[5-(3-methylpiperazin-1-yl)-2-nitro-phenyl]morpholine hydrochloride
MOLECULAR FORMULA: C15H23ClN4O3
MOLECULAR WEIGHT: 342.82112
SMILES: CC1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3.Cl
Structure:
CAS RN: 5813-59-2
CAS Name: (Z)-3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-2-thiazolyl]-2-propenenitrile
OPENEYE Name: (Z)-3-(4-chloro-2,5-dimethoxy-anilino)-2-[4-(4-methoxyphenyl)thiazol-2-yl]prop-2-enenitrile
IUPAC Name: (Z)-3-(4-chloro-2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
MOLECULAR FORMULA: C21H18ClN3O3S
MOLECULAR WEIGHT: 427.90392
SMILES: COC1=CC=C(C=C1)C2=CSC(=N2)/C(=C\NC3=CC(=C(C=C3OC)Cl)OC)/C#N
Structure:
CAS RN: 5813-21-8
CAS Name: 2,6-ditert-butyl-4-[(4-methoxyphenyl)-(4-morpholinyl)methyl]phenol
OPENEYE Name: 2,6-ditert-butyl-4-[(4-methoxyphenyl)-morpholino-methyl]phenol
IUPAC Name: 2,6-ditert-butyl-4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]phenol
SYSTEMATIC NAME: 2,6-ditert-butyl-4-[(4-methoxyphenyl)-morpholin-4-yl-methyl]phenol
MOLECULAR FORMULA: C26H37NO3
MOLECULAR WEIGHT: 411.57688
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2=CC=C(C=C2)OC)N3CCOCC3
Structure:
CAS RN: 5812-92-0
CAS Name: N'-[4-(1-adamantyl)-2-thiazolyl]-N-[2-(dimethylamino)ethyl]oxamide
OPENEYE Name: N'-[4-(1-adamantyl)thiazol-2-yl]-N-[2-(dimethylamino)ethyl]oxamide
IUPAC Name: N'-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-[2-(dimethylamino)ethyl]oxamide
SYSTEMATIC NAME: N'-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-[2-(dimethylamino)ethyl]ethanediamide
MOLECULAR FORMULA: C19H28N4O2S
MOLECULAR WEIGHT: 376.51622
SMILES: CN(C)CCNC(=O)C(=O)NC1=NC(=CS1)C23CC4CC(C2)CC(C4)C3
Structure:
CAS RN: 5812-73-7
CAS Name: 1-cyclohexyl-3-(1-cyclohexyl-3-diaziridinyl)diaziridine
OPENEYE Name: 1-cyclohexyl-3-(1-cyclohexyldiaziridin-3-yl)diaziridine
IUPAC Name: 1-cyclohexyl-3-(1-cyclohexyldiaziridin-3-yl)diaziridine
SYSTEMATIC NAME: 1-cyclohexyl-3-(1-cyclohexyl-1,2-diaziridin-3-yl)-1,2-diaziridine
MOLECULAR FORMULA: C14H26N4
MOLECULAR WEIGHT: 250.38304
SMILES: C1CCC(CC1)N2C(N2)C3NN3C4CCCCC4
Structure:
CAS RN: 5812-64-6
CAS Name: 1-(1-adamantyl)-4-bromo-N-(4-methylphenyl)-3-pyrazolecarboxamide
OPENEYE Name: 1-(1-adamantyl)-4-bromo-N-(p-tolyl)pyrazole-3-carboxamide
IUPAC Name: 1-(1-adamantyl)-4-bromo-N-(4-methylphenyl)pyrazole-3-carboxamide
SYSTEMATIC NAME: 1-(1-adamantyl)-4-bromanyl-N-(4-methylphenyl)pyrazole-3-carboxamide
MOLECULAR FORMULA: C21H24BrN3O
MOLECULAR WEIGHT: 414.33876
SMILES: CC1=CC=C(C=C1)NC(=O)C2=NN(C=C2Br)C34CC5CC(C3)CC(C5)C4
Structure:
CAS RN: 5812-15-7
CAS Name: (Z)-3-(2,3-dichloroanilino)-2-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-propenenitrile
OPENEYE Name: (Z)-3-(2,3-dichloroanilino)-2-[4-(2-oxochromen-3-yl)thiazol-2-yl]prop-2-enenitrile
IUPAC Name: (Z)-3-(2,3-dichloroanilino)-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-[[2,3-bis(chloranyl)phenyl]amino]-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
MOLECULAR FORMULA: C21H11Cl2N3O2S
MOLECULAR WEIGHT: 440.30194
SMILES: C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)/C(=C\NC4=C(C(=CC=C4)Cl)Cl)/C#N
Structure:
CAS RN: 5811-56-3
CAS Name: (Z)-3-(2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-2-thiazolyl]-2-propenenitrile
OPENEYE Name: (Z)-3-(2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)thiazol-2-yl]prop-2-enenitrile
IUPAC Name: (Z)-3-(2,5-dimethoxyanilino)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-[(2,5-dimethoxyphenyl)amino]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
MOLECULAR FORMULA: C21H19N3O3S
MOLECULAR WEIGHT: 393.45886
SMILES: COC1=CC=C(C=C1)C2=CSC(=N2)/C(=C\NC3=C(C=CC(=C3)OC)OC)/C#N
Structure:
CAS RN: 5811-28-9
CAS Name: 2,6-ditert-butyl-4-(3,4-dimethoxyphenyl)imino-1-cyclohexa-2,5-dienone
OPENEYE Name: 2,6-ditert-butyl-4-(3,4-dimethoxyphenyl)imino-cyclohexa-2,5-dien-1-one
IUPAC Name: 2,6-ditert-butyl-4-(3,4-dimethoxyphenyl)iminocyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-ditert-butyl-4-(3,4-dimethoxyphenyl)imino-cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C22H29NO3
MOLECULAR WEIGHT: 355.47056
SMILES: CC(C)(C)C1=CC(=NC2=CC(=C(C=C2)OC)OC)C=C(C1=O)C(C)(C)C
Structure:
CAS RN: 5809-58-5
CAS Name: 4-[[1-oxo-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)ethyl]amino]benzoic acid methyl ester
OPENEYE Name: methyl 4-[[2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetyl]amino]benzoate
IUPAC Name: methyl 4-[[2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetyl]amino]benzoate
SYSTEMATIC NAME: methyl 4-[2-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)ethanoylamino]benzoate
MOLECULAR FORMULA: C18H17N3O4
MOLECULAR WEIGHT: 339.34528
SMILES: COC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3N2
Structure:
CAS RN: 5808-71-9
CAS Name: 3-(4-nitrophenyl)-2-phenyl-5-(phenylmethyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
OPENEYE Name: 5-benzyl-3-(4-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
IUPAC Name: 5-benzyl-3-(4-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
SYSTEMATIC NAME: 3-(4-nitrophenyl)-2-phenyl-5-(phenylmethyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
MOLECULAR FORMULA: C24H19N3O5
MOLECULAR WEIGHT: 429.42476
SMILES: C1=CC=C(C=C1)CN2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]
Structure:
CAS RN: 5808-61-7
CAS Name: N-[4-(1-adamantyl)-5-methyl-2-thiazolyl]-2,4-dichlorobenzamide
OPENEYE Name: N-[4-(1-adamantyl)-5-methyl-thiazol-2-yl]-2,4-dichloro-benzamide
IUPAC Name: N-[4-(1-adamantyl)-5-methyl-1,3-thiazol-2-yl]-2,4-dichlorobenzamide
SYSTEMATIC NAME: N-[4-(1-adamantyl)-5-methyl-1,3-thiazol-2-yl]-2,4-bis(chloranyl)benzamide
MOLECULAR FORMULA: C21H22Cl2N2OS
MOLECULAR WEIGHT: 421.38318
SMILES: CC1=C(N=C(S1)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C34CC5CC(C3)CC(C5)C4
Structure:
CAS RN: 5808-50-4
CAS Name: 3-[(4-nitrophenyl)methylthio]-5,6-diphenyl-1,2,4-triazine
OPENEYE Name: 3-[(4-nitrophenyl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine
IUPAC Name: 3-[(4-nitrophenyl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine
SYSTEMATIC NAME: 3-[(4-nitrophenyl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine
MOLECULAR FORMULA: C22H16N4O2S
MOLECULAR WEIGHT: 400.45304
SMILES: C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4
Structure:
CAS RN: 5808-48-0
CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-(4-nitrophenyl)acetamide
OPENEYE Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(4-nitrophenyl)acetamide
IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide
SYSTEMATIC NAME: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(4-nitrophenyl)ethanamide
MOLECULAR FORMULA: C16H14N4O3S
MOLECULAR WEIGHT: 342.37236
SMILES: CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C
Structure:
CAS RN: 5807-77-2
CAS Name: 2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(2-propoxyphenyl)acetamide
OPENEYE Name: 2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(2-propoxyphenyl)acetamide
IUPAC Name: 2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(2-propoxyphenyl)acetamide
SYSTEMATIC NAME: 2-(6,7-dimethyl-3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)-N-(2-propoxyphenyl)ethanamide
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: CCCOC1=CC=CC=C1NC(=O)CC2C(=O)NC3=C(N2)C=C(C(=C3)C)C
Structure:
CAS RN: 5807-65-8
CAS Name: 1-(1-adamantyl)-2-(propylamino)-1-propanone hydrochloride
OPENEYE Name: 1-(1-adamantyl)-2-(propylamino)propan-1-one hydrochloride
IUPAC Name: 1-(1-adamantyl)-2-(propylamino)propan-1-one hydrochloride
SYSTEMATIC NAME: 1-(1-adamantyl)-2-(propylamino)propan-1-one hydrochloride
MOLECULAR FORMULA: C16H28ClNO
MOLECULAR WEIGHT: 285.85262
SMILES: CCCNC(C)C(=O)C12CC3CC(C1)CC(C3)C2.Cl
Structure:
CAS RN: 5807-07-8
CAS Name: 5-(3-chloro-4-methylanilino)-3-(4-methylphenyl)thiazolidine-2,4-dione
OPENEYE Name: 5-(3-chloro-4-methyl-anilino)-3-(p-tolyl)thiazolidine-2,4-dione
IUPAC Name: 5-(3-chloro-4-methylanilino)-3-(4-methylphenyl)-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[(3-chloranyl-4-methyl-phenyl)amino]-3-(4-methylphenyl)-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C17H15ClN2O2S
MOLECULAR WEIGHT: 346.8312
SMILES: CC1=CC=C(C=C1)N2C(=O)C(SC2=O)NC3=CC(=C(C=C3)C)Cl
Structure:
CAS RN: 5807-03-4
CAS Name: 2-[acetyl-[[5-bromo-2-[[(2-chlorophenyl)-oxomethyl]amino]phenyl]-phenylmethyl]amino]acetic acid methyl ester
OPENEYE Name: methyl 2-[acetyl-[[5-bromo-2-[(2-chlorobenzoyl)amino]phenyl]-phenyl-methyl]amino]acetate
IUPAC Name: methyl 2-[acetyl-[[5-bromo-2-[(2-chlorobenzoyl)amino]phenyl]-phenylmethyl]amino]acetate
SYSTEMATIC NAME: methyl 2-[[[5-bromanyl-2-[(2-chlorophenyl)carbonylamino]phenyl]-phenyl-methyl]-ethanoyl-amino]ethanoate
MOLECULAR FORMULA: C25H22BrClN2O4
MOLECULAR WEIGHT: 529.81018
SMILES: CC(=O)N(CC(=O)OC)C(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NC(=O)C3=CC=CC=C3Cl
Structure:
CAS RN: 132605-30-2
CAS Name: 6-methyl-3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
OPENEYE Name: 6-methyl-3-phenyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one
IUPAC Name: 6-methyl-3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 6-methyl-3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C17H16N2OS2
MOLECULAR WEIGHT: 328.45174
SMILES: CC1CCC2=C(C1)C3=C(S2)NC(=S)N(C3=O)C4=CC=CC=C4
Structure:
CAS RN: 5806-57-5
CAS Name: 2-[[anilino(sulfanylidene)methyl]amino]-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 5-ethyl-5-methyl-2-(phenylcarbamothioylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
IUPAC Name: ethyl 5-ethyl-5-methyl-2-(phenylcarbamothioylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
SYSTEMATIC NAME: ethyl 5-ethyl-5-methyl-2-(phenylcarbamothioylamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
MOLECULAR FORMULA: C20H24N2O3S2
MOLECULAR WEIGHT: 404.54616
SMILES: CCC1(CC2=C(CO1)SC(=C2C(=O)OCC)NC(=S)NC3=CC=CC=C3)C
Structure:
CAS RN: 5806-46-2
CAS Name: 2-[(1-ethyl-2-oxo-3-indolylidene)methyl]-3-(2-methylphenyl)-4-quinazolinone
OPENEYE Name: 2-[(1-ethyl-2-oxo-indolin-3-ylidene)methyl]-3-(o-tolyl)quinazolin-4-one
IUPAC Name: 2-[(1-ethyl-2-oxoindol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4-one
SYSTEMATIC NAME: 2-[(1-ethyl-2-oxidanylidene-indol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4-one
MOLECULAR FORMULA: C26H21N3O2
MOLECULAR WEIGHT: 407.46384
SMILES: CCN1C2=CC=CC=C2C(=CC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5C)C1=O
Structure:
CAS RN: 5806-30-4
CAS Name: 4-fluoro-N-[2-(1H-indol-3-yl)ethyl]-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)benzamide hydrochloride
OPENEYE Name: 4-fluoro-N-[2-(1H-indol-3-yl)ethyl]-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)benzamide hydrochloride
IUPAC Name: 4-fluoro-N-[2-(1H-indol-3-yl)ethyl]-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)benzamide hydrochloride
SYSTEMATIC NAME: 4-fluoranyl-N-[2-(1H-indol-3-yl)ethyl]-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)benzamide hydrochloride
MOLECULAR FORMULA: C25H27ClFN3O
MOLECULAR WEIGHT: 439.952783
SMILES: CN1C2CCC1C=C(C2)N(CCC3=CNC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)F.Cl
Structure:
CAS RN: 5806-17-7
CAS Name: N-[11-[3-(dimethylamino)-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid methyl ester hydrochloride
OPENEYE Name: methyl N-[11-[3-(dimethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: methyl N-[11-[3-(dimethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: methyl N-[11-[3-(dimethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C21H26ClN3O3
MOLECULAR WEIGHT: 403.90244
SMILES: CN(C)CCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC.Cl
Structure:
CAS RN: 78816-58-7
CAS Name: N-[11-[3-(dimethylamino)-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid methyl ester hydrochloride
OPENEYE Name: methyl N-[11-[3-(dimethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: methyl N-[11-[3-(dimethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: methyl N-[11-[3-(dimethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C21H26ClN3O3
MOLECULAR WEIGHT: 403.90244
SMILES: CN(C)CCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC.Cl
Structure:
CAS RN: 5805-33-4
CAS Name: 2,7,7-trimethyl-5-oxo-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-methoxyethyl ester
OPENEYE Name: 2-methoxyethyl 2,7,7-trimethyl-5-oxo-4-(2-thienyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate
IUPAC Name: 2-methoxyethyl 2,7,7-trimethyl-5-oxo-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate
SYSTEMATIC NAME: 2-methoxyethyl 2,7,7-trimethyl-5-oxidanylidene-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate
MOLECULAR FORMULA: C20H25NO4S
MOLECULAR WEIGHT: 375.4818
SMILES: CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CS3)C(=O)OCCOC
Structure:
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