CAS RN: 6090-23-9
CAS Name: 6-(2-furanyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
OPENEYE Name: 6-(2-furyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
IUPAC Name: 6-(furan-2-yl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: 6-(furan-2-yl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C23H20N2O2
MOLECULAR WEIGHT: 356.4171
SMILES: C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC=CO4)C5=CC=CC=C5
Structure:
CAS RN: 6087-61-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H20N4O3
MOLECULAR WEIGHT: 328.3657
SMILES: CCC(=O)N1C(C2C(=N1)C3CCN2CC3)C4=CC=C(C=C4)[N+](=O)[O-]
Structure:
CAS RN: 6085-80-9
CAS Name: acetic acid [4-[[3-[(2-methylpropylamino)-oxomethyl]anilino]-oxomethyl]phenyl] ester
OPENEYE Name: [4-[[3-(isobutylcarbamoyl)phenyl]carbamoyl]phenyl] acetate
IUPAC Name: [4-[[3-(2-methylpropylcarbamoyl)phenyl]carbamoyl]phenyl] acetate
SYSTEMATIC NAME: [4-[[3-(2-methylpropylcarbamoyl)phenyl]carbamoyl]phenyl] ethanoate
MOLECULAR FORMULA: C20H22N2O4
MOLECULAR WEIGHT: 354.39968
SMILES: CC(C)CNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)OC(=O)C
Structure:
CAS RN: 6085-50-3
CAS Name: 5-(2,5-dichlorophenyl)-N-(3-pyridinylmethyl)-2-furancarboxamide
OPENEYE Name: 5-(2,5-dichlorophenyl)-N-(3-pyridylmethyl)furan-2-carboxamide
IUPAC Name: 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
SYSTEMATIC NAME: 5-[2,5-bis(chloranyl)phenyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
MOLECULAR FORMULA: C17H12Cl2N2O2
MOLECULAR WEIGHT: 347.19538
SMILES: C1=CC(=CN=C1)CNC(=O)C2=CC=C(O2)C3=C(C=CC(=C3)Cl)Cl
Structure:
CAS RN: 6085-27-4
CAS Name: 2-benzoyl-6-(4-hydroxy-3-methoxyphenyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
OPENEYE Name: 2-benzoyl-6-(4-hydroxy-3-methoxy-phenyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
IUPAC Name: 2-benzoyl-6-(4-hydroxy-3-methoxyphenyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: 6-(3-methoxy-4-oxidanyl-phenyl)-9-phenyl-2-(phenylcarbonyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C33H28N2O4
MOLECULAR WEIGHT: 516.58642
SMILES: COC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=C(N2)C=CC(=C5)C(=O)C6=CC=CC=C6)O
Structure:
CAS RN: 6081-17-0
CAS Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine
OPENEYE Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine
IUPAC Name: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine
SYSTEMATIC NAME: N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine
MOLECULAR FORMULA: C10H12F3N3O2
MOLECULAR WEIGHT: 263.21639
SMILES: C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCN
Structure:
CAS RN: 6081-06-7
CAS Name: N-(5-nitro-2-thiazolyl)-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide
OPENEYE Name: N-(5-nitrothiazol-2-yl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide
IUPAC Name: N-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide
SYSTEMATIC NAME: N-(5-nitro-1,3-thiazol-2-yl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide
MOLECULAR FORMULA: C17H14N4O6S
MOLECULAR WEIGHT: 402.38126
SMILES: C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=NC=C(S4)[N+](=O)[O-]
Structure:
CAS RN: 6080-09-7
CAS Name: N-(4-methyl-2-nitrophenyl)-2-(3-methylphenoxy)acetamide
OPENEYE Name: N-(4-methyl-2-nitro-phenyl)-2-(3-methylphenoxy)acetamide
IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-(3-methylphenoxy)acetamide
SYSTEMATIC NAME: N-(4-methyl-2-nitro-phenyl)-2-(3-methylphenoxy)ethanamide
MOLECULAR FORMULA: C16H16N2O4
MOLECULAR WEIGHT: 300.30924
SMILES: CC1=CC(=CC=C1)OCC(=O)NC2=C(C=C(C=C2)C)[N+](=O)[O-]
Structure:
CAS RN: 6079-51-2
CAS Name: [5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone
OPENEYE Name: [5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone
IUPAC Name: [5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone
SYSTEMATIC NAME: [5-(4-chlorophenyl)-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C17H14ClN3O4
MOLECULAR WEIGHT: 359.76376
SMILES: CC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 6079-28-3
CAS Name: 3-[3-[3-[3-(4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-hydroxypropoxy]phenoxy]-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
OPENEYE Name: 3-[3-[3-[3-(4,4-dimethyl-2,5-dioxo-imidazolidin-1-yl)-2-hydroxy-propoxy]phenoxy]-2-hydroxy-propyl]-5,5-dimethyl-imidazolidine-2,4-dione
IUPAC Name: 3-[3-[3-[3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-hydroxypropoxy]phenoxy]-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
SYSTEMATIC NAME: 3-[3-[3-[3-[4,4-dimethyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]-2-oxidanyl-propoxy]phenoxy]-2-oxidanyl-propyl]-5,5-dimethyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C22H30N4O8
MOLECULAR WEIGHT: 478.4956
SMILES: CC1(C(=O)N(C(=O)N1)CC(COC2=CC(=CC=C2)OCC(CN3C(=O)C(NC3=O)(C)C)O)O)C
Structure:
CAS RN: 6079-09-0
CAS Name: 6-(3,4-difluorophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
OPENEYE Name: 6-(3,4-difluorophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
IUPAC Name: 6-(3,4-difluorophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: 6-[3,4-bis(fluoranyl)phenyl]-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C26H22F2N2O2
MOLECULAR WEIGHT: 432.461886
SMILES: COC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=C(C=C5)F)F)C(=O)C2
Structure:
CAS RN: 6078-61-1
CAS Name: 5-(4-ethoxyphenyl)-N-(2-hydroxy-5-methylphenyl)-7-methyl-2-pyrazolo[1,5-a]pyrimidinecarboxamide
OPENEYE Name: 5-(4-ethoxyphenyl)-N-(2-hydroxy-5-methyl-phenyl)-7-methyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide
IUPAC Name: 5-(4-ethoxyphenyl)-N-(2-hydroxy-5-methylphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-2-carboxamide
SYSTEMATIC NAME: 5-(4-ethoxyphenyl)-7-methyl-N-(5-methyl-2-oxidanyl-phenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
MOLECULAR FORMULA: C23H22N4O3
MOLECULAR WEIGHT: 402.44578
SMILES: CCOC1=CC=C(C=C1)C2=NC3=CC(=NN3C(=C2)C)C(=O)NC4=C(C=CC(=C4)C)O
Structure:
CAS RN: 6078-53-1
CAS Name: 2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,1-dioxo-1,2-benzothiazol-3-one
OPENEYE Name: 2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,1-dioxo-1,2-benzothiazol-3-one
IUPAC Name: 2-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,1-dioxo-1,2-benzothiazol-3-one
SYSTEMATIC NAME: 2-[3-(4-methoxyphenoxy)-2-oxidanyl-propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one
MOLECULAR FORMULA: C17H17NO6S
MOLECULAR WEIGHT: 363.38498
SMILES: COC1=CC=C(C=C1)OCC(CN2C(=O)C3=CC=CC=C3S2(=O)=O)O
Structure:
CAS RN: 6078-48-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21Cl2NO2
MOLECULAR WEIGHT: 354.27084
SMILES: COC1=CC=CC(=C1)NC(=O)C2C3C2CCC4C(C4(Cl)Cl)CC3
Structure:
CAS RN: 6078-34-8
CAS Name: 2-[N-(benzenesulfonyl)-4-methoxyanilino]-N-(2-oxolanylmethyl)acetamide
OPENEYE Name: 2-[N-(benzenesulfonyl)-4-methoxy-anilino]-N-(tetrahydrofuran-2-ylmethyl)acetamide
IUPAC Name: 2-[N-(benzenesulfonyl)-4-methoxyanilino]-N-(oxolan-2-ylmethyl)acetamide
SYSTEMATIC NAME: 2-[(4-methoxyphenyl)-(phenylsulfonyl)amino]-N-(oxolan-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C20H24N2O5S
MOLECULAR WEIGHT: 404.47996
SMILES: COC1=CC=C(C=C1)N(CC(=O)NCC2CCCO2)S(=O)(=O)C3=CC=CC=C3
Structure:
CAS RN: 6077-96-9
CAS Name: 2-cyclohexyl-3-(4-methylanilino)-3-oxopropanoic acid ethyl ester
OPENEYE Name: ethyl 2-cyclohexyl-3-(4-methylanilino)-3-oxo-propanoate
IUPAC Name: ethyl 2-cyclohexyl-3-(4-methylanilino)-3-oxopropanoate
SYSTEMATIC NAME: ethyl 2-cyclohexyl-3-[(4-methylphenyl)amino]-3-oxidanylidene-propanoate
MOLECULAR FORMULA: C18H25NO3
MOLECULAR WEIGHT: 303.396
SMILES: CCOC(=O)C(C1CCCCC1)C(=O)NC2=CC=C(C=C2)C
Structure:
CAS RN: 6077-59-4
CAS Name: 4-bromo-N-[4-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-2-phenyl-3-pyrazolyl]benzamide
OPENEYE Name: N-[4-(4-benzylpiperidine-1-carbonyl)-2-phenyl-pyrazol-3-yl]-4-bromo-benzamide
IUPAC Name: N-[4-(4-benzylpiperidine-1-carbonyl)-2-phenylpyrazol-3-yl]-4-bromobenzamide
SYSTEMATIC NAME: 4-bromanyl-N-[2-phenyl-4-[4-(phenylmethyl)piperidin-1-yl]carbonyl-pyrazol-3-yl]benzamide
MOLECULAR FORMULA: C29H27BrN4O2
MOLECULAR WEIGHT: 543.45428
SMILES: C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)Br
Structure:
CAS RN: 6077-56-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H23NO2
MOLECULAR WEIGHT: 393.47702
SMILES: CC1=C(C(=CC=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C)C
Structure:
CAS RN: 6077-54-9
CAS Name: 4-methoxybenzoic acid [2-methoxy-4-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]phenyl] ester
OPENEYE Name: [2-methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
IUPAC Name: [2-methoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl] 4-methoxybenzoate
SYSTEMATIC NAME: [2-methoxy-4-(4-methylpiperidin-1-yl)carbothioyl-phenyl] 4-methoxybenzoate
MOLECULAR FORMULA: C22H25NO4S
MOLECULAR WEIGHT: 399.5032
SMILES: CC1CCN(CC1)C(=S)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)OC)OC
Structure:
CAS RN: 6077-41-4
CAS Name: 3-(3-nitrophenyl)-2-phenyl-5-(phenylmethyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
OPENEYE Name: 5-benzyl-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
IUPAC Name: 5-benzyl-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
SYSTEMATIC NAME: 3-(3-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(=CC=C5)[N+](=O)[O-]
Structure:
CAS RN: 6076-89-7
CAS Name: 3-(benzenesulfonyl)-1-(4-bromophenyl)-3-(4-tert-butylphenyl)-1-propanone
OPENEYE Name: 3-(benzenesulfonyl)-1-(4-bromophenyl)-3-(4-tert-butylphenyl)propan-1-one
IUPAC Name: 3-(benzenesulfonyl)-1-(4-bromophenyl)-3-(4-tert-butylphenyl)propan-1-one
SYSTEMATIC NAME: 1-(4-bromophenyl)-3-(4-tert-butylphenyl)-3-(phenylsulfonyl)propan-1-one
MOLECULAR FORMULA: C25H25BrO3S
MOLECULAR WEIGHT: 485.4332
SMILES: CC(C)(C)C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3
Structure:
CAS RN: 6076-84-2
CAS Name: 4-hydroxypyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-oxo-2-(4-phenylphenyl)ethyl] ester
OPENEYE Name: O1-tert-butyl O2-[2-oxo-2-(4-phenylphenyl)ethyl] 4-hydroxypyrrolidine-1,2-dicarboxylate
IUPAC Name: 1-O-tert-butyl 2-O-[2-oxo-2-(4-phenylphenyl)ethyl] 4-hydroxypyrrolidine-1,2-dicarboxylate
SYSTEMATIC NAME: O1-tert-butyl O2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl] 4-oxidanylpyrrolidine-1,2-dicarboxylate
MOLECULAR FORMULA: C24H27NO6
MOLECULAR WEIGHT: 425.47428
SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)O
Structure:
CAS RN: 6076-18-2
CAS Name: 2,2-bis(3-methylphenyl)-N-(phenylmethyl)-1-cyclopropanecarboxamide
OPENEYE Name: N-benzyl-2,2-bis(m-tolyl)cyclopropanecarboxamide
IUPAC Name: N-benzyl-2,2-bis(3-methylphenyl)cyclopropane-1-carboxamide
SYSTEMATIC NAME: 2,2-bis(3-methylphenyl)-N-(phenylmethyl)cyclopropane-1-carboxamide
MOLECULAR FORMULA: C25H25NO
MOLECULAR WEIGHT: 355.4721
SMILES: CC1=CC=CC(=C1)C2(CC2C(=O)NCC3=CC=CC=C3)C4=CC(=CC=C4)C
Structure:
CAS RN: 6075-80-5
CAS Name: 5-(1-adamantyl)-2-phenyl-4H-pyrazol-3-one
OPENEYE Name: 5-(1-adamantyl)-2-phenyl-4H-pyrazol-3-one
IUPAC Name: 5-(1-adamantyl)-2-phenyl-4H-pyrazol-3-one
SYSTEMATIC NAME: 5-(1-adamantyl)-2-phenyl-4H-pyrazol-3-one
MOLECULAR FORMULA: C19H22N2O
MOLECULAR WEIGHT: 294.39078
SMILES: C1C2CC3CC1CC(C2)(C3)C4=NN(C(=O)C4)C5=CC=CC=C5
Structure:
CAS RN: 6075-28-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H21NO
MOLECULAR WEIGHT: 339.42964
SMILES: CC1=CC=C(C=C1)NC(=O)C2CC3C4=CC=CC=C4C2C5=CC=CC=C35
Structure:
CAS RN: 6075-19-0
CAS Name: 3-[2-hydroxy-3-(N-phenylanilino)propyl]-5,5-dimethylimidazolidine-2,4-dione
OPENEYE Name: 3-[2-hydroxy-3-(N-phenylanilino)propyl]-5,5-dimethyl-imidazolidine-2,4-dione
IUPAC Name: 3-[2-hydroxy-3-(N-phenylanilino)propyl]-5,5-dimethylimidazolidine-2,4-dione
SYSTEMATIC NAME: 3-[3-(diphenylamino)-2-oxidanyl-propyl]-5,5-dimethyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C20H23N3O3
MOLECULAR WEIGHT: 353.41492
SMILES: CC1(C(=O)N(C(=O)N1)CC(CN(C2=CC=CC=C2)C3=CC=CC=C3)O)C
Structure:
CAS RN: 6074-96-0
CAS Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-chlorophenyl)urea
OPENEYE Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-chlorophenyl)urea
IUPAC Name: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-chlorophenyl)urea
SYSTEMATIC NAME: 1-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-(4-chlorophenyl)urea
MOLECULAR FORMULA: C19H21ClN4OS
MOLECULAR WEIGHT: 388.91424
SMILES: C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)NC5=CC=C(C=C5)Cl
Structure:
CAS RN: 6074-59-5
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-nitrobenzenesulfonamide
OPENEYE Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-nitro-benzenesulfonamide
IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-nitrobenzenesulfonamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-nitro-benzenesulfonamide
MOLECULAR FORMULA: C15H14N2O7S
MOLECULAR WEIGHT: 366.34586
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]
Structure:
CAS RN: 6074-25-5
CAS Name: 9-(4-chlorophenyl)-6-(2-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
OPENEYE Name: 9-(4-chlorophenyl)-6-(2-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
IUPAC Name: 9-(4-chlorophenyl)-6-(2-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: 9-(4-chlorophenyl)-6-(2-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C25H20ClN3O3
MOLECULAR WEIGHT: 445.8976
SMILES: C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC=CC=C4[N+](=O)[O-])C5=CC=C(C=C5)Cl
Structure:
CAS RN: 6074-22-2
CAS Name: 5-(1,3-benzodioxol-5-yl)-N-(2-oxolanylmethyl)-7-(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinecarboxamide
OPENEYE Name: 5-(1,3-benzodioxol-5-yl)-N-(tetrahydrofuran-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-(oxolan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SYSTEMATIC NAME: 5-(1,3-benzodioxol-5-yl)-N-(oxolan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
MOLECULAR FORMULA: C20H17F3N4O4
MOLECULAR WEIGHT: 434.36859
SMILES: C1CC(OC1)CNC(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC5=C(C=C4)OCO5
Structure:
No comments:
Post a Comment