methyl 3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-methylphenyl)-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-methylphenyl)-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-[3-(4-methoxycarbonyl-4-phenyl-1-piperidyl)propylcarbamoyl]-6-methyl-2-oxo-4-(p-tolyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-[[3-(4-methoxycarbonyl-4-phenyl-1-piperidinyl)propylamino]-oxomethyl]-6-methyl-4-(4-methylphenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-(4-methoxycarbonyl-4-phenylpiperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-methylphenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-[3-(4-carbomethoxy-4-phenyl-piperidino)propylcarbamoyl]-2-keto-6-methyl-4-(p-tolyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C31H38N4O6 MolecularWeight: 562.65662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(NC(=O)N2C(=O)NCCCN3CCC(CC3)(C4=CC=CC=C4)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(NC(=O)N2C(=O)NCCCN3CCC(CC3)(C4=CC=CC=C4)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C31H38N4O6/c1-21-11-13-23(14-12-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-17-8-18-34-19-15-31(16-20-34,28(37)41-4)24-9-6-5-7-10-24/h5-7,9-14,26H,8,15-20H2,1-4H3,(H,32,38)(H,33,39)