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

Systemtic Name: methyl 3-[3-(4-methoxycarbonyl-4-phenyl-piperidin-1-yl)propylcarbamoyl]-6-methyl-4-(3-methylphenyl)-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-[3-(4-methoxycarbonyl-4-phenyl-1-piperidyl)propylcarbamoyl]-6-methyl-4-(m-tolyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-[[3-(4-methoxycarbonyl-4-phenyl-1-piperidinyl)propylamino]-oxomethyl]-6-methyl-4-(3-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-(3-methylphenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-[3-(4-carbomethoxy-4-phenyl-piperidino)propylcarbamoyl]-2-keto-6-methyl-4-(m-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=CC(=C1)C2C(=C(NC(=O)N2C(=O)NCCCN3CCC(CC3)(C4=CC=CC=C4)C(=O)OC)C)C(=O)OC

Isomeric SMILES

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

InChI

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