CAS RN: 5772-81-6
CAS Name: 4-amino-N'-[(3-methyl-2-thiophenyl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide
OPENEYE Name: 4-amino-N'-[(3-methyl-2-thienyl)methyleneamino]-1,2,5-oxadiazole-3-carboxamidine
IUPAC Name: 4-amino-N'-[(3-methylthiophen-2-yl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide
SYSTEMATIC NAME: 4-azanyl-N'-[(3-methylthiophen-2-yl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide
MOLECULAR FORMULA: C9H10N6OS
MOLECULAR WEIGHT: 250.2803
SMILES: CC1=C(SC=C1)C=NN=C(C2=NON=C2N)N
Structure:
CAS RN: 6428-23-5
CAS Name: 1-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(2-ethoxyethyl)piperazine
OPENEYE Name: 1-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(2-ethoxyethyl)piperazine
IUPAC Name: 1-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(2-ethoxyethyl)piperazine
SYSTEMATIC NAME: 1-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(2-ethoxyethyl)piperazine
MOLECULAR FORMULA: C22H28N2OS
MOLECULAR WEIGHT: 368.53552
SMILES: CCOCCN1CCN(CC1)C2C3=CC=CC=C3CSC4=CC=CC=C24
Structure:
CAS RN: 5321-01-7
CAS Name: 3-[5-(2,3-dichlorophenyl)-2-furanyl]-N-[[3-(5-methyl-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]-2-propenamide
OPENEYE Name: 3-[5-(2,3-dichlorophenyl)-2-furyl]-N-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]prop-2-enamide
IUPAC Name: 3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]prop-2-enamide
SYSTEMATIC NAME: 3-[5-[2,3-bis(chloranyl)phenyl]furan-2-yl]-N-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]prop-2-enamide
MOLECULAR FORMULA: C28H19Cl2N3O3S
MOLECULAR WEIGHT: 548.43976
SMILES: CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=S)NC(=O)C=CC4=CC=C(O4)C5=C(C(=CC=C5)Cl)Cl
Structure:
CAS RN: 5937-77-9
CAS Name: N-cyclohexyl-2-methyl-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]benzamide
OPENEYE Name: N-cyclohexyl-2-methyl-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]benzamide
IUPAC Name: N-cyclohexyl-2-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]benzamide
SYSTEMATIC NAME: N-cyclohexyl-2-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]benzamide
MOLECULAR FORMULA: C27H32N2O
MOLECULAR WEIGHT: 400.55578
SMILES: CC1=CC=CC=C1CN2C=CC=C2CN(C3CCCCC3)C(=O)C4=CC=CC=C4C
Structure:
CAS RN: 5937-16-6
CAS Name: 4-chloro-N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-(phenylmethyl)benzamide
OPENEYE Name: N-benzyl-4-chloro-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzamide
IUPAC Name: N-benzyl-4-chloro-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzamide
SYSTEMATIC NAME: 4-chloranyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)benzamide
MOLECULAR FORMULA: C26H22Cl2N2O
MOLECULAR WEIGHT: 449.37168
SMILES: C1=CC=C(C=C1)CN(CC2=CC=CN2CC3=CC=CC=C3Cl)C(=O)C4=CC=C(C=C4)Cl
Structure:
CAS RN: 5934-71-4
CAS Name: N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-phenyl-2-propenamide
OPENEYE Name: N-cyclohexyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-3-phenyl-prop-2-enamide
IUPAC Name: N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-phenylprop-2-enamide
SYSTEMATIC NAME: N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-phenyl-prop-2-enamide
MOLECULAR FORMULA: C28H32N2O
MOLECULAR WEIGHT: 412.56648
SMILES: CC1=CC(=CC=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)C=CC4=CC=CC=C4
Structure:
CAS RN: 5693-76-5
CAS Name: 2-bromobenzoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester
OPENEYE Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-bromobenzoate
IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-bromobenzoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2-bromanylbenzoate
MOLECULAR FORMULA: C13H10BrNO3
MOLECULAR WEIGHT: 308.1274
SMILES: C1=CC=C(C(=C1)C(=O)OCC(=O)C2=CC=CN2)Br
Structure:
CAS RN: 5985-69-3
CAS Name: 2-(3-chlorophenyl)-N-(3-methoxypropyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolecarboxamide
OPENEYE Name: 2-(3-chlorophenyl)-N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide
IUPAC Name: 2-(3-chlorophenyl)-N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide
SYSTEMATIC NAME: 2-(3-chlorophenyl)-N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide
MOLECULAR FORMULA: C19H21ClN4O2
MOLECULAR WEIGHT: 372.84864
SMILES: CN1C=CC=C1C2=NN(C(=C2)C(=O)NCCCOC)C3=CC(=CC=C3)Cl
Structure:
CAS RN: 5985-08-0
CAS Name: N-butan-2-yl-2-(2,4-dimethylphenyl)-5-(3,4-dimethylphenyl)-3-pyrazolecarboxamide
OPENEYE Name: 2-(2,4-dimethylphenyl)-5-(3,4-dimethylphenyl)-N-sec-butyl-pyrazole-3-carboxamide
IUPAC Name: N-butan-2-yl-2-(2,4-dimethylphenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carboxamide
SYSTEMATIC NAME: N-butan-2-yl-2-(2,4-dimethylphenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carboxamide
MOLECULAR FORMULA: C24H29N3O
MOLECULAR WEIGHT: 375.50656
SMILES: CCC(C)NC(=O)C1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC(=C(C=C3)C)C
Structure:
CAS RN: 6028-59-7
CAS Name: N-[4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-4-hexylbenzamide
OPENEYE Name: N-[4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-4-hexyl-benzamide
IUPAC Name: N-[4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-4-hexylbenzamide
SYSTEMATIC NAME: N-[4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-4-hexyl-benzamide
MOLECULAR FORMULA: C31H35FN4O3
MOLECULAR WEIGHT: 530.633003
SMILES: CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OCCOCC)C4=CC(=CC=C4)F
Structure:
CAS RN: 5267-21-0
CAS Name: 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-N-(3-propan-2-yloxypropyl)-2-propenamide
OPENEYE Name: 2-cyano-N-(3-isopropoxypropyl)-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
IUPAC Name: 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-N-(3-propan-2-yloxypropyl)prop-2-enamide
SYSTEMATIC NAME: 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-N-(3-propan-2-yloxypropyl)prop-2-enamide
MOLECULAR FORMULA: C26H28N4O4
MOLECULAR WEIGHT: 460.52492
SMILES: CC1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)C(=O)NCCCOC(C)C
Structure:
CAS RN: 5594-35-4
CAS Name: 6-bromo-3-[4-(3,4-dichlorophenyl)-2-thiazolyl]-1-benzopyran-2-one
OPENEYE Name: 6-bromo-3-[4-(3,4-dichlorophenyl)thiazol-2-yl]chromen-2-one
IUPAC Name: 6-bromo-3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]chromen-2-one
SYSTEMATIC NAME: 6-bromanyl-3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]chromen-2-one
MOLECULAR FORMULA: C18H8BrCl2NO2S
MOLECULAR WEIGHT: 453.13662
SMILES: C1=CC(=C(C=C1C2=CSC(=N2)C3=CC4=C(C=CC(=C4)Br)OC3=O)Cl)Cl
Structure:
CAS RN: 4118-59-6
CAS Name: cyclohepta-1,3,5-triene
OPENEYE Name: cyclohepta-1,3,5-triene
IUPAC Name: cyclohepta-1,3,5-triene
SYSTEMATIC NAME: cyclohepta-1,3,5-triene
MOLECULAR FORMULA: C7H7+
MOLECULAR WEIGHT: 91.13048
SMILES: C1=CC=C[CH+]C=C1
Structure:
CAS RN: 5273-23-4
CAS Name: 2-(diethoxyphosphinothioylthio)acetic acid 2-(4-phenoxyphenoxy)ethyl ester
OPENEYE Name: 2-(4-phenoxyphenoxy)ethyl 2-diethoxyphosphinothioylsulfanylacetate
IUPAC Name: 2-(4-phenoxyphenoxy)ethyl 2-diethoxyphosphinothioylsulfanylacetate
SYSTEMATIC NAME: 2-(4-phenoxyphenoxy)ethyl 2-diethoxyphosphinothioylsulfanylethanoate
MOLECULAR FORMULA: C20H25O6PS2
MOLECULAR WEIGHT: 456.512661
SMILES: CCOP(=S)(OCC)SCC(=O)OCCOC1=CC=C(C=C1)OC2=CC=CC=C2
Structure:
CAS RN: 6893-03-4
CAS Name: 5-methyl-2-[[1-oxo-3-(4-propoxyphenyl)prop-2-enyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester
OPENEYE Name: methyl 5-methyl-4-phenyl-2-[3-(4-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate
IUPAC Name: methyl 5-methyl-4-phenyl-2-[3-(4-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 5-methyl-4-phenyl-2-[3-(4-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate
MOLECULAR FORMULA: C25H25NO4S
MOLECULAR WEIGHT: 435.5353
SMILES: CCCOC1=CC=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC
Structure:
CAS RN: 6616-17-7
CAS Name: 3-[5-[[2-(diethylamino)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid
OPENEYE Name: 3-[5-[[2-(diethylamino)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid
IUPAC Name: 3-[5-[[2-(diethylamino)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
SYSTEMATIC NAME: 3-[5-[[2-(diethylamino)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
MOLECULAR FORMULA: C20H22N4O4S2
MOLECULAR WEIGHT: 446.54308
SMILES: CCN(CC)C1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CCC(=O)O
Structure:
CAS RN: 5484-93-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H19N3O5
MOLECULAR WEIGHT: 417.41406
SMILES: C1C2C=CC1C3C2C(=O)N(C3=O)N=CC4=C(C=CC(=C4)[N+](=O)[O-])OCC5=CC=CC=C5
Structure:
CAS RN: 5484-32-2
CAS Name: 3-(2-methoxyphenyl)-2-propenoic acid [2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] ester
OPENEYE Name: [2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl] 3-(2-methoxyphenyl)prop-2-enoate
IUPAC Name: [2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 3-(2-methoxyphenyl)prop-2-enoate
SYSTEMATIC NAME: [2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl] 3-(2-methoxyphenyl)prop-2-enoate
MOLECULAR FORMULA: C21H21NO4
MOLECULAR WEIGHT: 351.39574
SMILES: COC1=CC=CC=C1C=CC(=O)OCC(=O)N2CCCC3=CC=CC=C32
Structure:
No comments:
Post a Comment