ethyl 2-[4-(diphenylmethyl)piperazin-1-yl]-4-(3-methylphenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[4-(diphenylmethyl)piperazin-1-yl]-4-(3-methylphenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-benzhydrylpiperazin-1-yl)-4-(m-tolyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-4-(3-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-benzhydrylpiperazin-1-yl)-4-(3-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-(4-benzhydrylpiperazino)-6-keto-4-(m-tolyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C31H34N4O3 MolecularWeight: 510.62666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)C

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)C

InChI

InChI=1S/C31H34N4O3/c1-3-38-30(37)26-27(25-16-10-11-22(2)21-25)32-31(33-29(26)36)35-19-17-34(18-20-35)28(23-12-6-4-7-13-23)24-14-8-5-9-15-24/h4-16,21,26-28H,3,17-20H2,1-2H3,(H,32,33,36)