CAS RN: 6184-61-8
CAS Name: 1-[4-[4-[1-(3-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]phenyl]ethanone
OPENEYE Name: 1-[4-[4-[1-(m-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]phenyl]ethanone
IUPAC Name: 1-[4-[4-[1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]phenyl]ethanone
SYSTEMATIC NAME: 1-[4-[4-[1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]phenyl]ethanone
MOLECULAR FORMULA: C24H24N6O
MOLECULAR WEIGHT: 412.48696
SMILES: CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC=C(C=C5)C(=O)C
Structure:
CAS RN: 5913-51-9
CAS Name: methanesulfonic acid [4-[[[(3-fluoroanilino)-oxomethyl]-(3-methoxypropyl)amino]methyl]phenyl] ester
OPENEYE Name: [4-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate
IUPAC Name: [4-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate
SYSTEMATIC NAME: [4-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate
MOLECULAR FORMULA: C19H23FN2O5S
MOLECULAR WEIGHT: 410.459723
SMILES: COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC(=CC=C2)F
Structure:
CAS RN: 6334-38-9
CAS Name: 4-methyl-2,2-bis(trifluoromethyl)pyrido[1,2-a][1,3,5]triazine
OPENEYE Name: 4-methyl-2,2-bis(trifluoromethyl)pyrido[1,2-a][1,3,5]triazine
IUPAC Name: 4-methyl-2,2-bis(trifluoromethyl)pyrido[1,2-a][1,3,5]triazine
SYSTEMATIC NAME: 4-methyl-2,2-bis(trifluoromethyl)pyrido[1,2-a][1,3,5]triazine
MOLECULAR FORMULA: C10H7F6N3
MOLECULAR WEIGHT: 283.173099
SMILES: CC1=NC(N=C2N1C=CC=C2)(C(F)(F)F)C(F)(F)F
Structure:
CAS RN: 5542-46-1
CAS Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methyl-2-thiophenyl)-2-propenamide
OPENEYE Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methyl-2-thienyl)prop-2-enamide
IUPAC Name: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methylthiophen-2-yl)prop-2-enamide
SYSTEMATIC NAME: 2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-(3-methylthiophen-2-yl)prop-2-enamide
MOLECULAR FORMULA: C19H17N3OS
MOLECULAR WEIGHT: 335.42278
SMILES: CC1=C(SC=C1)C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32
Structure:
CAS RN: 5287-04-7
CAS Name: N-[1-(2-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl]-N'-(1-oxo-2-phenoxyethyl)-3-pyridinecarbohydrazide
OPENEYE Name: N-[1-(2-fluorophenyl)-2,5-dioxo-pyrrolidin-3-yl]-N'-(2-phenoxyacetyl)pyridine-3-carbohydrazide
IUPAC Name: N-[1-(2-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]-N'-(2-phenoxyacetyl)pyridine-3-carbohydrazide
SYSTEMATIC NAME: N-[1-(2-fluorophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-N'-(2-phenoxyethanoyl)pyridine-3-carbohydrazide
MOLECULAR FORMULA: C24H19FN4O5
MOLECULAR WEIGHT: 462.429863
SMILES: C1C(C(=O)N(C1=O)C2=CC=CC=C2F)N(C(=O)C3=CN=CC=C3)NC(=O)COC4=CC=CC=C4
Structure:
CAS RN: 6254-66-6
CAS Name: [2-[(4-nitrophenyl)methylthio]-4,5-dihydroimidazol-1-yl]-[3-(trifluoromethyl)phenyl]methanone
OPENEYE Name: [2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-[3-(trifluoromethyl)phenyl]methanone
IUPAC Name: [2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-[3-(trifluoromethyl)phenyl]methanone
SYSTEMATIC NAME: [2-[(4-nitrophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-[3-(trifluoromethyl)phenyl]methanone
MOLECULAR FORMULA: C18H14F3N3O3S
MOLECULAR WEIGHT: 409.38227
SMILES: C1CN(C(=N1)SCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=CC=C3)C(F)(F)F
Structure:
CAS RN: 6254-05-3
CAS Name: [2-(ethylthio)-4,5-dihydroimidazol-1-yl]-thiophen-2-ylmethanone
OPENEYE Name: (2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-(2-thienyl)methanone
IUPAC Name: (2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-thiophen-2-ylmethanone
SYSTEMATIC NAME: (2-ethylsulfanyl-4,5-dihydroimidazol-1-yl)-thiophen-2-yl-methanone
MOLECULAR FORMULA: C10H12N2OS2
MOLECULAR WEIGHT: 240.34508
SMILES: CCSC1=NCCN1C(=O)C2=CC=CS2
Structure:
CAS RN: 5654-22-8
CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid [2-[[6-methyl-3-[oxo(propan-2-yloxy)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl] ester
OPENEYE Name: [2-[(3-isopropoxycarbonyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl] 4-oxochromene-2-carboxylate
IUPAC Name: [2-[(6-methyl-3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-[(6-methyl-3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidenechromene-2-carboxylate
MOLECULAR FORMULA: C25H25NO7S
MOLECULAR WEIGHT: 483.5335
SMILES: CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)COC(=O)C3=CC(=O)C4=CC=CC=C4O3
Structure:
CAS RN: 6331-93-7
CAS Name: [6-(4-bromophenyl)-5-pyrrolo[2,1-b]thiazolyl]methanamine
OPENEYE Name: [6-(4-bromophenyl)pyrrolo[2,1-b]thiazol-5-yl]methanamine
IUPAC Name: [6-(4-bromophenyl)pyrrolo[2,1-b][1,3]thiazol-5-yl]methanamine
SYSTEMATIC NAME: [6-(4-bromophenyl)pyrrolo[2,1-b][1,3]thiazol-5-yl]methanamine
MOLECULAR FORMULA: C13H11BrN2S
MOLECULAR WEIGHT: 307.20884
SMILES: C1=CC(=CC=C1C2=C(N3C=CSC3=C2)CN)Br
Structure:
CAS RN: 4655-36-1
CAS Name: 1-(3,5-dichlorophenyl)-3-(propylamino)pyrrolidine-2,5-dione
OPENEYE Name: 1-(3,5-dichlorophenyl)-3-(propylamino)pyrrolidine-2,5-dione
IUPAC Name: 1-(3,5-dichlorophenyl)-3-(propylamino)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-[3,5-bis(chloranyl)phenyl]-3-(propylamino)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C13H14Cl2N2O2
MOLECULAR WEIGHT: 301.16846
SMILES: CCCNC1CC(=O)N(C1=O)C2=CC(=CC(=C2)Cl)Cl
Structure:
CAS RN: 6017-61-4
CAS Name: N-[(4-fluorophenyl)methyl]-N-(2-furanylmethyl)-2-[2-methylpropyl-[oxo-[2-(trifluoromethyl)anilino]methyl]amino]acetamide
OPENEYE Name: N-[(4-fluorophenyl)methyl]-N-(2-furylmethyl)-2-[isobutyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]acetamide
IUPAC Name: N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-2-[2-methylpropyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]acetamide
SYSTEMATIC NAME: N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-2-[2-methylpropyl-[[2-(trifluoromethyl)phenyl]carbamoyl]amino]ethanamide
MOLECULAR FORMULA: C26H27F4N3O3
MOLECULAR WEIGHT: 505.504493
SMILES: CC(C)CN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CO2)C(=O)NC3=CC=CC=C3C(F)(F)F
Structure:
CAS RN: 5481-24-3
CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-prop-2-enylacetamide
OPENEYE Name: N-allyl-2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]acetamide
IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-prop-2-enylacetamide
SYSTEMATIC NAME: 2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-prop-2-enyl-ethanamide
MOLECULAR FORMULA: C18H25ClN2O4S
MOLECULAR WEIGHT: 400.9201
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC=C)C2CCCCC2)Cl
Structure:
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