CAS RN: 6926-95-0
CAS Name: 3-cyano-6-methyl-2-(phenacylthio)-7,8-dihydro-5H-1,6-naphthyridine-4-carboxylic acid ethyl ester
OPENEYE Name: ethyl 3-cyano-6-methyl-2-phenacylsulfanyl-7,8-dihydro-5H-1,6-naphthyridine-4-carboxylate
IUPAC Name: ethyl 3-cyano-6-methyl-2-phenacylsulfanyl-7,8-dihydro-5H-1,6-naphthyridine-4-carboxylate
SYSTEMATIC NAME: ethyl 3-cyano-6-methyl-2-phenacylsulfanyl-7,8-dihydro-5H-1,6-naphthyridine-4-carboxylate
MOLECULAR FORMULA: C21H21N3O3S
MOLECULAR WEIGHT: 395.47474
SMILES: CCOC(=O)C1=C(C(=NC2=C1CN(CC2)C)SCC(=O)C3=CC=CC=C3)C#N
Structure:
CAS RN: 6926-94-9
CAS Name: 3-amino-2-benzoyl-6-ethyl-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-4-carboxylic acid ethyl ester
OPENEYE Name: ethyl 3-amino-2-benzoyl-6-ethyl-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-4-carboxylate
IUPAC Name: ethyl 3-amino-2-benzoyl-6-ethyl-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-4-carboxylate
SYSTEMATIC NAME: ethyl 3-azanyl-6-ethyl-2-(phenylcarbonyl)-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-4-carboxylate
MOLECULAR FORMULA: C22H23N3O3S
MOLECULAR WEIGHT: 409.50132
SMILES: CCN1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)C4=CC=CC=C4)N)C(=O)OCC
Structure:
CAS RN: 6926-93-8
CAS Name: 2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N,N-diethylacetamide
OPENEYE Name: 2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N,N-diethyl-acetamide
IUPAC Name: 2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N,N-diethylacetamide
SYSTEMATIC NAME: 2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N,N-diethyl-ethanamide
MOLECULAR FORMULA: C14H16F3N3OS
MOLECULAR WEIGHT: 331.35655
SMILES: CCN(CC)C(=O)CSC1=C(C(=CC(=N1)C)C(F)(F)F)C#N
Structure:
CAS RN: 6938-40-5
CAS Name: 2,4,6-trimethylbenzenesulfonic acid [(2-methyl-4-oxo-5-propan-2-yl-1-cyclohexa-2,5-dienylidene)amino] ester
OPENEYE Name: [(5-isopropyl-2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 2,4,6-trimethylbenzenesulfonate
IUPAC Name: [(2-methyl-4-oxo-5-propan-2-ylcyclohexa-2,5-dien-1-ylidene)amino] 2,4,6-trimethylbenzenesulfonate
SYSTEMATIC NAME: [(2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)amino] 2,4,6-trimethylbenzenesulfonate
MOLECULAR FORMULA: C19H23NO4S
MOLECULAR WEIGHT: 361.45522
SMILES: CC1=CC(=C(C(=C1)C)S(=O)(=O)ON=C2C=C(C(=O)C=C2C)C(C)C)C
Structure:
CAS RN: 7050-72-8
CAS Name: 2-(3,4-diethoxyphenyl)-1-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2H-pyrrol-5-one
OPENEYE Name: 2-(3,4-diethoxyphenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2H-pyrrol-5-one
IUPAC Name: 2-(3,4-diethoxyphenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one
SYSTEMATIC NAME: 2-(3,4-diethoxyphenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2H-pyrrol-5-one
MOLECULAR FORMULA: C33H28FN3O7S2
MOLECULAR WEIGHT: 661.719723
SMILES: CCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=C(C=C4)F)O)C(=O)C5=CC6=C(O5)C(=CC=C6)OC)OCC
Structure:
CAS RN: 7050-71-7
CAS Name: 2-(2-fluorophenyl)-1-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2H-pyrrol-5-one
OPENEYE Name: 2-(2-fluorophenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2H-pyrrol-5-one
IUPAC Name: 2-(2-fluorophenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one
SYSTEMATIC NAME: 2-(2-fluorophenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2H-pyrrol-5-one
MOLECULAR FORMULA: C29H19F2N3O5S2
MOLECULAR WEIGHT: 591.605066
SMILES: COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC=CC=C4F)C5=NN=C(S5)SCC6=CC=C(C=C6)F)O
Structure:
CAS RN: 6978-41-2
CAS Name: N-[(2-chloroanilino)-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide
OPENEYE Name: N-[(2-chlorophenyl)carbamothioyl]-2-(1-naphthyl)acetamide
IUPAC Name: N-[(2-chlorophenyl)carbamothioyl]-2-naphthalen-1-ylacetamide
SYSTEMATIC NAME: N-[(2-chlorophenyl)carbamothioyl]-2-naphthalen-1-yl-ethanamide
MOLECULAR FORMULA: C19H15ClN2OS
MOLECULAR WEIGHT: 354.8532
SMILES: C1=CC=C2C(=C1)C=CC=C2CC(=O)NC(=S)NC3=CC=CC=C3Cl
Structure:
CAS RN: 6978-40-1
CAS Name: 2-(2-chlorophenoxy)-N-[(hexadecylamino)-sulfanylidenemethyl]acetamide
OPENEYE Name: 2-(2-chlorophenoxy)-N-(hexadecylcarbamothioyl)acetamide
IUPAC Name: 2-(2-chlorophenoxy)-N-(hexadecylcarbamothioyl)acetamide
SYSTEMATIC NAME: 2-(2-chloranylphenoxy)-N-(hexadecylcarbamothioyl)ethanamide
MOLECULAR FORMULA: C25H41ClN2O2S
MOLECULAR WEIGHT: 469.12324
SMILES: CCCCCCCCCCCCCCCCNC(=S)NC(=O)COC1=CC=CC=C1Cl
Structure:
CAS RN: 7018-27-1
CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
OPENEYE Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)-4-[hydroxy-(3-methoxyphenyl)methylene]pyrrolidine-2,3-dione
IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
SYSTEMATIC NAME: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)-4-[(3-methoxyphenyl)-oxidanyl-methylidene]pyrrolidine-2,3-dione
MOLECULAR FORMULA: C25H16ClFN2O4S
MOLECULAR WEIGHT: 494.921943
SMILES: COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)Cl)C5=CC=C(C=C5)F)O
Structure:
CAS RN: 7026-92-8
CAS Name: N,4-diphenyl-3-propyl-2-thiazolimine
OPENEYE Name: N,4-diphenyl-3-propyl-thiazol-2-imine
IUPAC Name: N,4-diphenyl-3-propyl-1,3-thiazol-2-imine
SYSTEMATIC NAME: N,4-diphenyl-3-propyl-1,3-thiazol-2-imine
MOLECULAR FORMULA: C18H18N2S
MOLECULAR WEIGHT: 294.41392
SMILES: CCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 7026-91-7
CAS Name: 3-(2-furanylmethyl)-N-phenyl-4-[4-(1-piperidinylsulfonyl)phenyl]-2-thiazolimine
OPENEYE Name: 3-(2-furylmethyl)-N-phenyl-4-[4-(1-piperidylsulfonyl)phenyl]thiazol-2-imine
IUPAC Name: 3-(furan-2-ylmethyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine
SYSTEMATIC NAME: 3-(furan-2-ylmethyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine
MOLECULAR FORMULA: C25H25N3O3S2
MOLECULAR WEIGHT: 479.6143
SMILES: C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CC5=CC=CO5
Structure:
CAS RN: 6998-31-8
CAS Name: 7-methyl-5-[4-(methylthio)phenyl]-2-[[4-(methylthio)phenyl]methylidene]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid propan-2-yl ester
OPENEYE Name: isopropyl 7-methyl-5-(4-methylsulfanylphenyl)-2-[(4-methylsulfanylphenyl)methylene]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC Name: propan-2-yl 7-methyl-5-(4-methylsulfanylphenyl)-2-[(4-methylsulfanylphenyl)methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: propan-2-yl 7-methyl-5-(4-methylsulfanylphenyl)-2-[(4-methylsulfanylphenyl)methylidene]-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C26H26N2O3S3
MOLECULAR WEIGHT: 510.69124
SMILES: CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)SC)SC2=N1)C4=CC=C(C=C4)SC)C(=O)OC(C)C
Structure:
CAS RN: 7006-89-5
CAS Name: 1-benzimidazolyl-(4-bromo-3,5-dinitrophenyl)methanone
OPENEYE Name: benzimidazol-1-yl-(4-bromo-3,5-dinitro-phenyl)methanone
IUPAC Name: benzimidazol-1-yl-(4-bromo-3,5-dinitrophenyl)methanone
SYSTEMATIC NAME: benzimidazol-1-yl-(4-bromanyl-3,5-dinitro-phenyl)methanone
MOLECULAR FORMULA: C14H7BrN4O5
MOLECULAR WEIGHT: 391.13318
SMILES: C1=CC=C2C(=C1)N=CN2C(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])Br)[N+](=O)[O-]
Structure:
CAS RN: 7038-29-1
CAS Name: 3-methoxy-N-[(3-methoxy-4-pentoxyphenyl)-[[(3-methoxyphenyl)-oxomethyl]amino]methyl]benzamide
OPENEYE Name: 3-methoxy-N-[[(3-methoxybenzoyl)amino]-(3-methoxy-4-pentoxy-phenyl)methyl]benzamide
IUPAC Name: 3-methoxy-N-[[(3-methoxybenzoyl)amino]-(3-methoxy-4-pentoxyphenyl)methyl]benzamide
SYSTEMATIC NAME: 3-methoxy-N-[(3-methoxy-4-pentoxy-phenyl)-[(3-methoxyphenyl)carbonylamino]methyl]benzamide
MOLECULAR FORMULA: C29H34N2O6
MOLECULAR WEIGHT: 506.59006
SMILES: CCCCCOC1=C(C=C(C=C1)C(NC(=O)C2=CC(=CC=C2)OC)NC(=O)C3=CC(=CC=C3)OC)OC
Structure:
CAS RN: 7050-70-6
CAS Name: 1-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(3-methoxyphenyl)-2H-pyrrol-5-one
OPENEYE Name: 1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2-(3-methoxyphenyl)-2H-pyrrol-5-one
IUPAC Name: 1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(3-methoxyphenyl)-2H-pyrrol-5-one
SYSTEMATIC NAME: 1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(3-methoxyphenyl)-4-oxidanyl-2H-pyrrol-5-one
MOLECULAR FORMULA: C30H22FN3O6S2
MOLECULAR WEIGHT: 603.640583
SMILES: COC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=C(C=C4)F)O)C(=O)C5=CC6=C(O5)C(=CC=C6)OC
Structure:
CAS RN: 7050-69-3
CAS Name: 2-(3,4-dichlorophenyl)-1-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2H-pyrrol-5-one
OPENEYE Name: 2-(3,4-dichlorophenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2H-pyrrol-5-one
IUPAC Name: 2-(3,4-dichlorophenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one
SYSTEMATIC NAME: 2-(3,4-dichlorophenyl)-1-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2H-pyrrol-5-one
MOLECULAR FORMULA: C29H18Cl2FN3O5S2
MOLECULAR WEIGHT: 642.504723
SMILES: COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC(=C(C=C4)Cl)Cl)C5=NN=C(S5)SCC6=CC=C(C=C6)F)O
Structure:
CAS RN: 6978-39-8
CAS Name: 2-(2-chlorophenoxy)-N-[[4-[(4-ethoxyphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]acetamide
OPENEYE Name: 2-(2-chlorophenoxy)-N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]acetamide
IUPAC Name: 2-(2-chlorophenoxy)-N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]acetamide
SYSTEMATIC NAME: 2-(2-chloranylphenoxy)-N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]ethanamide
MOLECULAR FORMULA: C23H22ClN3O5S2
MOLECULAR WEIGHT: 520.02088
SMILES: CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=CC=C3Cl
Structure:
CAS RN: 5972-89-4
CAS Name: 4-[[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]amino]-oxomethyl]amino]benzoic acid ethyl ester
OPENEYE Name: ethyl 4-[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxo-ethyl]carbamoyl]amino]benzoate
IUPAC Name: ethyl 4-[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]carbamoyl]amino]benzoate
SYSTEMATIC NAME: ethyl 4-[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]carbamoyl]amino]benzoate
MOLECULAR FORMULA: C33H34FN3O6
MOLECULAR WEIGHT: 587.637963
SMILES: CCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)NC4=CC=C(C=C4)C(=O)OCC
Structure:
CAS RN: 5884-44-6
CAS Name: 2-[[(2-bromoanilino)-oxomethyl]-butylamino]-N-[5-methyl-2-(4-methylphenyl)-4-phenyl-3-pyrazolyl]acetamide
OPENEYE Name: 2-[(2-bromophenyl)carbamoyl-butyl-amino]-N-[5-methyl-4-phenyl-2-(p-tolyl)pyrazol-3-yl]acetamide
IUPAC Name: 2-[(2-bromophenyl)carbamoyl-butylamino]-N-[5-methyl-2-(4-methylphenyl)-4-phenylpyrazol-3-yl]acetamide
SYSTEMATIC NAME: 2-[(2-bromophenyl)carbamoyl-butyl-amino]-N-[5-methyl-2-(4-methylphenyl)-4-phenyl-pyrazol-3-yl]ethanamide
MOLECULAR FORMULA: C30H32BrN5O2
MOLECULAR WEIGHT: 574.51138
SMILES: CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=C(C=C2)C)C)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4Br
Structure:
CAS RN: 6468-44-6
CAS Name: 5-(3,4-dimethoxyphenyl)-2-[(7-methoxy-2-phenyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 5-(3,4-dimethoxyphenyl)-2-[(7-methoxy-2-phenyl-1H-indol-3-yl)methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC Name: ethyl 5-(3,4-dimethoxyphenyl)-2-[(7-methoxy-2-phenyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 5-(3,4-dimethoxyphenyl)-2-[(7-methoxy-2-phenyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C34H31N3O6S
MOLECULAR WEIGHT: 609.69144
SMILES: CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=C(NC5=C4C=CC=C5OC)C6=CC=CC=C6)S2)C
Structure:
CAS RN: 6217-20-5
CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-3,5-dimethoxybenzamide
OPENEYE Name: N-benzo[e][1,3]benzothiazol-2-yl-3,5-dimethoxy-benzamide
IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-3,5-dimethoxybenzamide
SYSTEMATIC NAME: N-benzo[e][1,3]benzothiazol-2-yl-3,5-dimethoxy-benzamide
MOLECULAR FORMULA: C20H16N2O3S
MOLECULAR WEIGHT: 364.41764
SMILES: COC1=CC(=CC(=C1)C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)OC
Structure:
CAS RN: 6160-46-9
CAS Name: 2-amino-4-(4-bromo-5-ethyl-2-thiophenyl)-1-(4-methoxy-2-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
OPENEYE Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(4-methoxy-2-nitro-phenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
IUPAC Name: 2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-1-(4-methoxy-2-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(4-methoxy-2-nitro-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile
MOLECULAR FORMULA: C23H21BrN4O4S
MOLECULAR WEIGHT: 529.40624
SMILES: CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=C(C=C4)OC)[N+](=O)[O-])N)C#N)Br
Structure:
CAS RN: 6158-63-0
CAS Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-nitrobenzamide
OPENEYE Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-nitro-benzamide
IUPAC Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-nitrobenzamide
SYSTEMATIC NAME: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-nitro-benzamide
MOLECULAR FORMULA: C15H18N4O3S
MOLECULAR WEIGHT: 334.39342
SMILES: CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=NN=C(S2)CC(C)(C)C
Structure:
CAS RN: 6156-17-8
CAS Name: N-[4-(hexylsulfamoyl)phenyl]-3-methyl-2-nitrobenzamide
OPENEYE Name: N-[4-(hexylsulfamoyl)phenyl]-3-methyl-2-nitro-benzamide
IUPAC Name: N-[4-(hexylsulfamoyl)phenyl]-3-methyl-2-nitrobenzamide
SYSTEMATIC NAME: N-[4-(hexylsulfamoyl)phenyl]-3-methyl-2-nitro-benzamide
MOLECULAR FORMULA: C20H25N3O5S
MOLECULAR WEIGHT: 419.4946
SMILES: CCCCCCNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-]
Structure:
CAS RN: 6153-72-6
CAS Name: 3-methyl-N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide
OPENEYE Name: 3-methyl-N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide
IUPAC Name: 3-methyl-N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide
SYSTEMATIC NAME: 3-methyl-N-[2-(5-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide
MOLECULAR FORMULA: C21H15N3O4
MOLECULAR WEIGHT: 373.3615
SMILES: CC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C3=NC4=C(O3)C=CC(=C4)[N+](=O)[O-]
Structure:
CAS RN: 669726-50-5
CAS Name: 3-[1-(3,4-dimethylphenoxy)ethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-allyl-3-[1-(3,4-dimethylphenoxy)ethyl]-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-[1-(3,4-dimethylphenoxy)ethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-[1-(3,4-dimethylphenoxy)ethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C15H19N3OS
MOLECULAR WEIGHT: 289.39586
SMILES: CC1=C(C=C(C=C1)OC(C)C2=NNC(=S)N2CC=C)C
Structure:
CAS RN: 5269-40-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H20BrN5O3
MOLECULAR WEIGHT: 518.362
SMILES: CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=NC(=O)C4=CC=CC=C4Br)N3CC5CCCO5)C#N
Structure:
CAS RN: 5974-89-0
CAS Name: 1-[4-[[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-3,3-dimethyl-1-butanone
OPENEYE Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazin-1-yl]-3,3-dimethyl-butan-1-one
IUPAC Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazin-1-yl]-3,3-dimethylbutan-1-one
SYSTEMATIC NAME: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]-3,3-dimethyl-butan-1-one
MOLECULAR FORMULA: C29H34ClN3O3
MOLECULAR WEIGHT: 508.05156
SMILES: CC1=C(C=C(N1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)Cl)C(=O)N4CCN(CC4)C(=O)CC(C)(C)C
Structure:
CAS RN: 5974-88-9
CAS Name: 1-[4-[[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-hexanone
OPENEYE Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one
IUPAC Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one
SYSTEMATIC NAME: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one
MOLECULAR FORMULA: C29H34ClN3O3
MOLECULAR WEIGHT: 508.05156
SMILES: CCCCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC)C
Structure:
CAS RN: 5329-72-6
CAS Name: 3-chloro-4-ethoxy-N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)anilino]-sulfanylidenemethyl]benzamide
OPENEYE Name: 3-chloro-4-ethoxy-N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide
IUPAC Name: 3-chloro-4-ethoxy-N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide
SYSTEMATIC NAME: 3-chloranyl-4-ethoxy-N-[[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl]benzamide
MOLECULAR FORMULA: C20H17ClN6O2S2
MOLECULAR WEIGHT: 472.97098
SMILES: CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NN4C(=NN=C4S3)C)Cl
Structure:
CAS RN: 5729-14-6
CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenylpropanamide
OPENEYE Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenyl-propanamide
IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenylpropanamide
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-phenyl-propanamide
MOLECULAR FORMULA: C26H21N3O4S
MOLECULAR WEIGHT: 471.52764
SMILES: CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O
Structure:
CAS RN: 5299-10-5
CAS Name: N-[5-(2-methyl-3-phenylprop-2-enylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-pyridinecarboxamide
OPENEYE Name: N-[5-(2-methyl-3-phenyl-prop-2-enylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]pyridine-4-carboxamide
IUPAC Name: N-[5-(2-methyl-3-phenylprop-2-enylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pyridine-4-carboxamide
SYSTEMATIC NAME: N-[5-(2-methyl-3-phenyl-prop-2-enylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pyridine-4-carboxamide
MOLECULAR FORMULA: C19H15N3O2S2
MOLECULAR WEIGHT: 381.4713
SMILES: CC(=CC1=CC=CC=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=NC=C3
Structure:
CAS RN: 5939-67-3
CAS Name: 3-(3-cyanophenyl)-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-pentylurea
OPENEYE Name: 3-(3-cyanophenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea
IUPAC Name: 3-(3-cyanophenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentylurea
SYSTEMATIC NAME: 3-(3-cyanophenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea
MOLECULAR FORMULA: C25H27FN4O
MOLECULAR WEIGHT: 418.506483
SMILES: CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=CC(=C3)C#N
Structure:
CAS RN: 5677-93-0
CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester
OPENEYE Name: (3,5-dimethylisoxazol-4-yl)methyl 4-morpholino-3-nitro-benzoate
IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-morpholin-4-yl-3-nitrobenzoate
SYSTEMATIC NAME: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-morpholin-4-yl-3-nitro-benzoate
MOLECULAR FORMULA: C17H19N3O6
MOLECULAR WEIGHT: 361.34926
SMILES: CC1=C(C(=NO1)C)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]
Structure:
CAS RN: 5675-47-8
CAS Name: 2-tert-butyl-4-[(3-ethoxy-4-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid
OPENEYE Name: 2-tert-butyl-4-[(3-ethoxy-4-methoxy-phenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid
IUPAC Name: 2-tert-butyl-4-[(3-ethoxy-4-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid
SYSTEMATIC NAME: 2-tert-butyl-4-[(3-ethoxy-4-methoxy-phenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid
MOLECULAR FORMULA: C28H31NO4
MOLECULAR WEIGHT: 445.55004
SMILES: CCOC1=C(C=CC(=C1)C=C2CC(CC3=C(C4=CC=CC=C4N=C23)C(=O)O)C(C)(C)C)OC
Structure:
CAS RN: 5672-41-3
CAS Name: 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-[4-(difluoromethoxy)phenyl]acetamide
OPENEYE Name: 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
IUPAC Name: 2-[(6,8-dichloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
SYSTEMATIC NAME: 2-[[6,8-bis(chloranyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl]-N-[4-[bis(fluoranyl)methoxy]phenyl]ethanamide
MOLECULAR FORMULA: C15H10Cl2F2N4O2S
MOLECULAR WEIGHT: 419.233306
SMILES: C1=CC(=CC=C1NC(=O)CSC2=NN=C3N2C=C(C=C3Cl)Cl)OC(F)F
Structure:
CAS RN: 5055-65-2
CAS Name: 5-chloro-2-(4-ethylphenyl)-2,3-dihydro-1H-indole
OPENEYE Name: 5-chloro-2-(4-ethylphenyl)indoline
IUPAC Name: 5-chloro-2-(4-ethylphenyl)-2,3-dihydro-1H-indole
SYSTEMATIC NAME: 5-chloranyl-2-(4-ethylphenyl)-2,3-dihydro-1H-indole
MOLECULAR FORMULA: C16H16ClN
MOLECULAR WEIGHT: 257.75794
SMILES: CCC1=CC=C(C=C1)C2CC3=C(N2)C=CC(=C3)Cl
Structure:
CAS RN: 6006-57-1
CAS Name: 2-[[2-[acetyl(cyclopropyl)amino]-1-oxoethyl]amino]-N-(4-methylphenyl)acetamide
OPENEYE Name: 2-[[2-[acetyl(cyclopropyl)amino]acetyl]amino]-N-(p-tolyl)acetamide
IUPAC Name: 2-[[2-[acetyl(cyclopropyl)amino]acetyl]amino]-N-(4-methylphenyl)acetamide
SYSTEMATIC NAME: 2-[2-[cyclopropyl(ethanoyl)amino]ethanoylamino]-N-(4-methylphenyl)ethanamide
MOLECULAR FORMULA: C16H21N3O3
MOLECULAR WEIGHT: 303.35624
SMILES: CC1=CC=C(C=C1)NC(=O)CNC(=O)CN(C2CC2)C(=O)C
Structure:
CAS RN: 6011-41-2
CAS Name: N-butyl-N-[2-[2-(1H-indol-3-yl)ethyl-(phenylmethyl)amino]-2-oxoethyl]-2-methylpropanamide
OPENEYE Name: N-[2-[benzyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]-N-butyl-2-methyl-propanamide
IUPAC Name: N-[2-[benzyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-butyl-2-methylpropanamide
SYSTEMATIC NAME: N-butyl-N-[2-[2-(1H-indol-3-yl)ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-2-methyl-propanamide
MOLECULAR FORMULA: C27H35N3O2
MOLECULAR WEIGHT: 433.5857
SMILES: CCCCN(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)C(C)C
Structure:
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