CAS RN: 5571-69-7
CAS Name: 4-chloro-N'-[1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]benzohydrazide
OPENEYE Name: 4-chloro-N'-[1-(5-chloro-2-methoxy-phenyl)-2,5-dioxo-pyrrolidin-3-yl]benzohydrazide
IUPAC Name: 4-chloro-N'-[1-(5-chloro-2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]benzohydrazide
SYSTEMATIC NAME: 4-chloranyl-N'-[1-(5-chloranyl-2-methoxy-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]benzohydrazide
MOLECULAR FORMULA: C18H15Cl2N3O4
MOLECULAR WEIGHT: 408.2354
SMILES: COC1=C(C=C(C=C1)Cl)N2C(=O)CC(C2=O)NNC(=O)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 5937-86-0
CAS Name: N-butyl-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-2-phenyl-1-cyclopropanecarboxamide
OPENEYE Name: N-butyl-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-2-phenyl-cyclopropanecarboxamide
IUPAC Name: N-butyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-2-phenylcyclopropane-1-carboxamide
SYSTEMATIC NAME: N-butyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-2-phenyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C27H32N2O
MOLECULAR WEIGHT: 400.55578
SMILES: CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)C3CC3C4=CC=CC=C4
Structure:
CAS RN: 5932-95-6
CAS Name: 3-ethyl-4-methyl-2-oxo-6-[4-[(1-oxo-2-phenylbutyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl 3-ethyl-4-methyl-2-oxo-6-[4-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate
IUPAC Name: ethyl 3-ethyl-4-methyl-2-oxo-6-[4-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 3-ethyl-4-methyl-2-oxidanylidene-6-[4-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C26H31N3O4
MOLECULAR WEIGHT: 449.54204
SMILES: CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C3C(=C(N(C(=O)N3)CC)C)C(=O)OCC
Structure:
CAS RN: 5932-34-3
CAS Name: 5-[[(3-methylphenyl)methyl-propan-2-ylamino]methyl]-N-(2-phenylethyl)-2-furancarboxamide
OPENEYE Name: 5-[[isopropyl(m-tolylmethyl)amino]methyl]-N-(2-phenylethyl)furan-2-carboxamide
IUPAC Name: 5-[[(3-methylphenyl)methyl-propan-2-ylamino]methyl]-N-(2-phenylethyl)furan-2-carboxamide
SYSTEMATIC NAME: 5-[[(3-methylphenyl)methyl-propan-2-yl-amino]methyl]-N-(2-phenylethyl)furan-2-carboxamide
MOLECULAR FORMULA: C25H30N2O2
MOLECULAR WEIGHT: 390.5179
SMILES: CC1=CC(=CC=C1)CN(CC2=CC=C(O2)C(=O)NCCC3=CC=CC=C3)C(C)C
Structure:
CAS RN: 6467-97-6
CAS Name: 5-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-[2-(4-morpholinyl)-2-oxoethyl]thiazolidine-2,4-dione
OPENEYE Name: 5-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylene]-3-(2-morpholino-2-oxo-ethyl)thiazolidine-2,4-dione
IUPAC Name: 5-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C25H25FN2O6S
MOLECULAR WEIGHT: 500.539203
SMILES: CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCOCC3)OCC4=CC=CC=C4F
Structure:
CAS RN: 3438-85-5
CAS Name: 7-[(2,4-dichlorophenyl)methylthio]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
OPENEYE Name: 7-[(2,4-dichlorophenyl)methylsulfanyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
IUPAC Name: 7-[(2,4-dichlorophenyl)methylsulfanyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
SYSTEMATIC NAME: 7-[(2,4-dichlorophenyl)methylsulfanyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
MOLECULAR FORMULA: C12H8Cl2N4S2
MOLECULAR WEIGHT: 343.25472
SMILES: C1=CC(=C(C=C1Cl)Cl)CSC2=C3C(=NC=N3)C(=S)NN2
Structure:
CAS RN: 5040-43-7
CAS Name: 7-[(2,4-dichlorophenyl)methylthio]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
OPENEYE Name: 7-[(2,4-dichlorophenyl)methylsulfanyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
IUPAC Name: 7-[(2,4-dichlorophenyl)methylsulfanyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
SYSTEMATIC NAME: 7-[(2,4-dichlorophenyl)methylsulfanyl]-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
MOLECULAR FORMULA: C12H8Cl2N4S2
MOLECULAR WEIGHT: 343.25472
SMILES: C1=CC(=C(C=C1Cl)Cl)CSC2=C3C(=NC=N3)C(=S)NN2
Structure:
CAS RN: 77409-39-3
CAS Name: 1-methyl-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
OPENEYE Name: 5-allyl-1-methyl-5-(1-methylbutyl)-2-thioxo-hexahydropyrimidine-4,6-dione
IUPAC Name: 1-methyl-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
SYSTEMATIC NAME: 1-methyl-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
MOLECULAR FORMULA: C13H20N2O2S
MOLECULAR WEIGHT: 268.3751
SMILES: CCCC(C)C1(C(=O)NC(=S)N(C1=O)C)CC=C
Structure:
CAS RN: 5845-01-2
CAS Name: 4-fluorobenzoic acid [4-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester
OPENEYE Name: [4-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazono]methyl]-2-ethoxy-phenyl] 4-fluorobenzoate
IUPAC Name: [4-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-2-ethoxyphenyl] 4-fluorobenzoate
SYSTEMATIC NAME: [4-[[[2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]hydrazinylidene]methyl]-2-ethoxy-phenyl] 4-fluoranylbenzoate
MOLECULAR FORMULA: C33H26FN3O7
MOLECULAR WEIGHT: 595.573843
SMILES: CCOC1=C(C=CC(=C1)C=NNC(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)F
Structure:
CAS RN: 5970-06-9
CAS Name: N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-2-fluoro-N-propylbenzamide
OPENEYE Name: N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-2-fluoro-N-propyl-benzamide
IUPAC Name: N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-2-fluoro-N-propylbenzamide
SYSTEMATIC NAME: N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-2-fluoranyl-N-propyl-benzamide
MOLECULAR FORMULA: C25H23Cl2FN2O2S
MOLECULAR WEIGHT: 505.431723
SMILES: CCCN(CC(=O)N1CCC2=C(C1C3=C(C=C(C=C3)Cl)Cl)C=CS2)C(=O)C4=CC=CC=C4F
Structure:
CAS RN: 5892-86-4
CAS Name: N-[(4-fluorophenyl)methyl]-5-[(1-oxo-2,2-diphenylethyl)amino]-2-(1-pyrrolidinyl)benzamide
OPENEYE Name: 5-[(2,2-diphenylacetyl)amino]-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-yl-benzamide
IUPAC Name: 5-[(2,2-diphenylacetyl)amino]-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-ylbenzamide
SYSTEMATIC NAME: 5-(2,2-diphenylethanoylamino)-N-[(4-fluorophenyl)methyl]-2-pyrrolidin-1-yl-benzamide
MOLECULAR FORMULA: C32H30FN3O2
MOLECULAR WEIGHT: 507.597903
SMILES: C1CCN(C1)C2=C(C=C(C=C2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NCC5=CC=C(C=C5)F
Structure:
CAS RN: 5892-25-1
CAS Name: N-butan-2-yl-5-[(2-ethyl-1-oxohexyl)amino]-2-(1-pyrrolidinyl)benzamide
OPENEYE Name: 5-(2-ethylhexanoylamino)-2-pyrrolidin-1-yl-N-sec-butyl-benzamide
IUPAC Name: N-butan-2-yl-5-(2-ethylhexanoylamino)-2-pyrrolidin-1-ylbenzamide
SYSTEMATIC NAME: N-butan-2-yl-5-(2-ethylhexanoylamino)-2-pyrrolidin-1-yl-benzamide
MOLECULAR FORMULA: C23H37N3O2
MOLECULAR WEIGHT: 387.55878
SMILES: CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NC(C)CC
Structure:
CAS RN: 5888-57-3
CAS Name: N-(3,4-dimethylphenyl)-3-[oxo(thiophen-2-yl)methyl]-2-propyl-4-thiazolidinecarboxamide
OPENEYE Name: N-(3,4-dimethylphenyl)-2-propyl-3-(thiophene-2-carbonyl)thiazolidine-4-carboxamide
IUPAC Name: N-(3,4-dimethylphenyl)-2-propyl-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-2-propyl-3-thiophen-2-ylcarbonyl-1,3-thiazolidine-4-carboxamide
MOLECULAR FORMULA: C20H24N2O2S2
MOLECULAR WEIGHT: 388.54676
SMILES: CCCC1N(C(CS1)C(=O)NC2=CC(=C(C=C2)C)C)C(=O)C3=CC=CS3
Structure:
CAS RN: 4598-90-7
CAS Name: 1-tert-butyl-5-[(4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
OPENEYE Name: 5-[(4-benzyloxyphenyl)methylene]-1-tert-butyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 1-tert-butyl-5-[(4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 1-tert-butyl-5-[(4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C22H22N2O4
MOLECULAR WEIGHT: 378.42108
SMILES: CC(C)(C)N1C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)NC1=O
Structure:
CAS RN: 6604-86-0
CAS Name: 2-chloro-N-(4-chloro-3-nitrophenyl)-2-phenylacetamide
OPENEYE Name: 2-chloro-N-(4-chloro-3-nitro-phenyl)-2-phenyl-acetamide
IUPAC Name: 2-chloro-N-(4-chloro-3-nitrophenyl)-2-phenylacetamide
SYSTEMATIC NAME: 2-chloranyl-N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-ethanamide
MOLECULAR FORMULA: C14H10Cl2N2O3
MOLECULAR WEIGHT: 325.1468
SMILES: C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl
Structure:
CAS RN: 6259-60-5
CAS Name: 4-bromo-N-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)benzamide
OPENEYE Name: 4-bromo-N-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)benzamide
IUPAC Name: 4-bromo-N-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)benzamide
SYSTEMATIC NAME: 4-bromanyl-N-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)benzamide
MOLECULAR FORMULA: C20H19BrN2O
MOLECULAR WEIGHT: 383.28166
SMILES: C1CCC2=C(C1)C3=C(N2)C=CC(=C3)CNC(=O)C4=CC=C(C=C4)Br
Structure:
CAS RN: 6813-23-6
CAS Name: 4-[[2,2,3,3-tetrafluoro-1-oxo-3-(trifluoromethoxy)propyl]amino]benzoate
OPENEYE Name: 4-[[2,2,3,3-tetrafluoro-3-(trifluoromethoxy)propanoyl]amino]benzoate
IUPAC Name: 4-[[2,2,3,3-tetrafluoro-3-(trifluoromethoxy)propanoyl]amino]benzoate
SYSTEMATIC NAME: 4-[[2,2,3,3-tetrakis(fluoranyl)-3-(trifluoromethyloxy)propanoyl]amino]benzoate
MOLECULAR FORMULA: C11H5F7NO4-
MOLECULAR WEIGHT: 348.150522
SMILES: C1=CC(=CC=C1C(=O)[O-])NC(=O)C(C(OC(F)(F)F)(F)F)(F)F
Structure:
CAS RN: 5824-54-4
CAS Name: 6-[[4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxy-5-iodophenyl]methylidene]-5-imino-2-(4-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
OPENEYE Name: 6-[[4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxy-5-iodo-phenyl]methylene]-5-imino-2-(p-tolyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
IUPAC Name: 6-[[4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxy-5-iodophenyl]methylidene]-5-imino-2-(4-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SYSTEMATIC NAME: 5-azanylidene-6-[[4-[2-(2,5-dimethylphenoxy)ethoxy]-3-ethoxy-5-iodanyl-phenyl]methylidene]-2-(4-methylphenyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
MOLECULAR FORMULA: C31H29IN4O4S
MOLECULAR WEIGHT: 680.55583
SMILES: CCOC1=C(C(=CC(=C1)C=C2C(=N)N3C(=NC2=O)SC(=N3)C4=CC=C(C=C4)C)I)OCCOC5=C(C=CC(=C5)C)C
Structure:
CAS RN: 5902-81-8
CAS Name: 2-[butyl-(1-oxo-2-phenylmethoxyethyl)amino]-N-[(1-methyl-2-pyrrolyl)methyl]-N-(phenylmethyl)acetamide
OPENEYE Name: N-benzyl-2-[(2-benzyloxyacetyl)-butyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide
IUPAC Name: N-benzyl-2-[butyl-(2-phenylmethoxyacetyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[butyl(2-phenylmethoxyethanoyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C28H35N3O3
MOLECULAR WEIGHT: 461.5958
SMILES: CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)COCC3=CC=CC=C3
Structure:
CAS RN: 5902-20-5
CAS Name: N-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-chlorobenzamide
OPENEYE Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-2-chloro-benzamide
IUPAC Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-2-chlorobenzamide
SYSTEMATIC NAME: N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-2-chloranyl-benzamide
MOLECULAR FORMULA: C28H30ClN3O2
MOLECULAR WEIGHT: 476.0097
SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Cl
Structure:
CAS RN: 5640-97-1
CAS Name: 2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-8-ethoxy-1-benzopyran-3-carboxamide
OPENEYE Name: 2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)imino]-8-ethoxy-chromene-3-carboxamide
IUPAC Name: 2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-8-ethoxychromene-3-carboxamide
SYSTEMATIC NAME: 2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-8-ethoxy-chromene-3-carboxamide
MOLECULAR FORMULA: C21H19N3O3S
MOLECULAR WEIGHT: 393.45886
SMILES: CCOC1=CC=CC2=C1OC(=NC3=C(C4=C(S3)CCCC4)C#N)C(=C2)C(=O)N
Structure:
CAS RN: 4831-91-8
CAS Name: 4-[hydroxy-(3-methoxyphenyl)methylidene]-1-[3-(1-imidazolyl)propyl]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
OPENEYE Name: 4-[hydroxy-(3-methoxyphenyl)methylene]-1-(3-imidazol-1-ylpropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
IUPAC Name: 4-[hydroxy-(3-methoxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
SYSTEMATIC NAME: 1-(3-imidazol-1-ylpropyl)-4-[(3-methoxyphenyl)-oxidanyl-methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
MOLECULAR FORMULA: C24H22N4O6
MOLECULAR WEIGHT: 462.45468
SMILES: COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC(=CC=C4)[N+](=O)[O-])O
Structure:
CAS RN: 6808-11-3
CAS Name: 5-[(2-chlorophenyl)methyl]-3-[4-morpholinyl(oxo)methyl]-6-benzo[b][1,4]benzothiazepinone
OPENEYE Name: 5-[(2-chlorophenyl)methyl]-3-(morpholine-4-carbonyl)benzo[b][1,4]benzothiazepin-6-one
IUPAC Name: 5-[(2-chlorophenyl)methyl]-3-(morpholine-4-carbonyl)benzo[b][1,4]benzothiazepin-6-one
SYSTEMATIC NAME: 5-[(2-chlorophenyl)methyl]-3-morpholin-4-ylcarbonyl-benzo[b][1,4]benzothiazepin-6-one
MOLECULAR FORMULA: C25H21ClN2O3S
MOLECULAR WEIGHT: 464.96384
SMILES: C1COCCN1C(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5Cl
Structure:
CAS RN: 6706-69-0
CAS Name: N-(2,4-difluorophenyl)-4-quinazolinamine
OPENEYE Name: N-(2,4-difluorophenyl)quinazolin-4-amine
IUPAC Name: N-(2,4-difluorophenyl)quinazolin-4-amine
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]quinazolin-4-amine
MOLECULAR FORMULA: C14H9F2N3
MOLECULAR WEIGHT: 257.238166
SMILES: C1=CC=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)F)F
Structure:
CAS RN: 6706-68-9
CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium
OPENEYE Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium
IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium
SYSTEMATIC NAME: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium
MOLECULAR FORMULA: C18H19ClNO3+
MOLECULAR WEIGHT: 332.80136
SMILES: CC1=CC2=C(C[NH+](CO2)CC3=CC4=C(C=C3)OCO4)C(=C1Cl)C
Structure:
CAS RN: 4980-46-5
CAS Name: 3-(4-bromophenyl)-5-isoxazolamine
OPENEYE Name: 3-(4-bromophenyl)isoxazol-5-amine
IUPAC Name: 3-(4-bromophenyl)-1,2-oxazol-5-amine
SYSTEMATIC NAME: 3-(4-bromophenyl)-1,2-oxazol-5-amine
MOLECULAR FORMULA: C9H7BrN2O
MOLECULAR WEIGHT: 239.06868
SMILES: C1=CC(=CC=C1C2=NOC(=C2)N)Br
Structure:
CAS RN: 4976-78-7
CAS Name: 5-(1-azepanylsulfonyl)-2-(2,5-dichloro-3-thiophenyl)-1H-indole-3-carboxaldehyde
OPENEYE Name: 5-(azepan-1-ylsulfonyl)-2-(2,5-dichloro-3-thienyl)-1H-indole-3-carbaldehyde
IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-(2,5-dichlorothiophen-3-yl)-1H-indole-3-carbaldehyde
SYSTEMATIC NAME: 5-(azepan-1-ylsulfonyl)-2-[2,5-bis(chloranyl)thiophen-3-yl]-1H-indole-3-carbaldehyde
MOLECULAR FORMULA: C19H18Cl2N2O3S2
MOLECULAR WEIGHT: 457.39382
SMILES: C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=C3C=O)C4=C(SC(=C4)Cl)Cl
Structure:
CAS RN: 5968-23-0
CAS Name: N-(3-chlorophenyl)-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide
OPENEYE Name: N-(3-chlorophenyl)-4-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide
IUPAC Name: N-(3-chlorophenyl)-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide
MOLECULAR FORMULA: C22H24ClN5OS
MOLECULAR WEIGHT: 441.97686
SMILES: CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCCN(CC3)C(=O)NC4=CC(=CC=C4)Cl
Structure:
CAS RN: 5963-93-9
CAS Name: 3,5-dimethoxy-N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-propan-2-ylbenzamide
OPENEYE Name: N-isopropyl-3,5-dimethoxy-N-[2-oxo-2-[4-(p-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]benzamide
IUPAC Name: 3,5-dimethoxy-N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-propan-2-ylbenzamide
SYSTEMATIC NAME: 3,5-dimethoxy-N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-propan-2-yl-benzamide
MOLECULAR FORMULA: C28H32N2O4S
MOLECULAR WEIGHT: 492.62968
SMILES: CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)CN(C(C)C)C(=O)C4=CC(=CC(=C4)OC)OC)SC=C3
Structure:
CAS RN: 5963-32-6
CAS Name: ethanesulfonic acid [4-[[butan-2-yl-[(3-cyanoanilino)-oxomethyl]amino]methyl]phenyl] ester
OPENEYE Name: [4-[[(3-cyanophenyl)carbamoyl-sec-butyl-amino]methyl]phenyl] ethanesulfonate
IUPAC Name: [4-[[butan-2-yl-[(3-cyanophenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate
SYSTEMATIC NAME: [4-[[butan-2-yl-[(3-cyanophenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate
MOLECULAR FORMULA: C21H25N3O4S
MOLECULAR WEIGHT: 415.5059
SMILES: CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)CC)C(=O)NC2=CC=CC(=C2)C#N
Structure:
CAS RN: 4796-29-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H30N2O2
MOLECULAR WEIGHT: 414.5393
SMILES: C1CCC(CC1)C2=CC3=C(C=C2)N4CCN(C5C4=C3CCC5)C(=O)OC6=CC=CC=C6
Structure:
CAS RN: 5271-11-4
CAS Name: 1-(2-fluorophenyl)-2-(2-furanylmethyl)-6,7-dimethyl-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione
OPENEYE Name: 1-(2-fluorophenyl)-2-(2-furylmethyl)-6,7-dimethyl-1H-chromeno[2,3-c]pyrrole-3,9-dione
IUPAC Name: 1-(2-fluorophenyl)-2-(furan-2-ylmethyl)-6,7-dimethyl-1H-chromeno[2,3-c]pyrrole-3,9-dione
SYSTEMATIC NAME: 1-(2-fluorophenyl)-2-(furan-2-ylmethyl)-6,7-dimethyl-1H-chromeno[2,3-c]pyrrole-3,9-dione
MOLECULAR FORMULA: C24H18FNO4
MOLECULAR WEIGHT: 403.402423
SMILES: CC1=C(C=C2C(=C1)C(=O)C3=C(O2)C(=O)N(C3C4=CC=CC=C4F)CC5=CC=CO5)C
Structure:
CAS RN: 5269-44-3
CAS Name: 5-[3-[4-(3-chlorophenyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]benzene-1,3-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxo-pyrrolidin-1-yl]benzene-1,3-dicarboxylate
IUPAC Name: diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate
SYSTEMATIC NAME: diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzene-1,3-dicarboxylate
MOLECULAR FORMULA: C26H28ClN3O6
MOLECULAR WEIGHT: 513.97002
SMILES: CCOC(=O)C1=CC(=CC(=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C(=O)OCC
Structure:
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