methyl 4-[3,4-bis(fluoranyl)phenyl]-3-[3-[4-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]propylcarbamoyl]-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-[3,4-bis(fluoranyl)phenyl]-3-[3-[4-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]propylcarbamoyl]-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-(3,4-difluorophenyl)-3-[3-[4-(3-ethyl-2-oxo-benzimidazol-1-yl)-1-piperidyl]propylcarbamoyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(3,4-difluorophenyl)-3-[[3-[4-(3-ethyl-2-oxo-1-benzimidazolyl)-1-piperidinyl]propylamino]-oxomethyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(3,4-difluorophenyl)-3-[3-[4-(3-ethyl-2-oxobenzimidazol-1-yl)piperidin-1-yl]propylcarbamoyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(3,4-difluorophenyl)-3-[3-[4-(3-ethyl-2-keto-benzimidazol-1-yl)piperidino]propylcarbamoyl]-2-keto-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C31H36F2N6O5 MolecularWeight: 610.651546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3)CCCNC(=O)N4C(C(=C(NC4=O)C)C(=O)OC)C5=CC(=C(C=C5)F)F

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3)CCCNC(=O)N4C(C(=C(NC4=O)C)C(=O)OC)C5=CC(=C(C=C5)F)F

InChI

InChI=1S/C31H36F2N6O5/c1-4-37-24-8-5-6-9-25(24)38(31(37)43)21-12-16-36(17-13-21)15-7-14-34-29(41)39-27(20-10-11-22(32)23(33)18-20)26(28(40)44-3)19(2)35-30(39)42/h5-6,8-11,18,21,27H,4,7,12-17H2,1-3H3,(H,34,41)(H,35,42)