2-methylpropyl 4-methyl-2-oxidanylidene-6-[3-[(phenylmethyl)carbamoylamino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl 4-methyl-2-oxidanylidene-6-[3-[(phenylmethyl)carbamoylamino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 6-[3-(benzylcarbamoylamino)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-[3-(benzylcarbamoylamino)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(benzylcarbamoylamino)phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=C3)C(=O)OCC(C)C)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=C3)C(=O)OCC(C)C)C

InChI

InChI=1S/C27H34N4O4/c1-5-14-31-19(4)23(25(32)35-17-18(2)3)24(30-27(31)34)21-12-9-13-22(15-21)29-26(33)28-16-20-10-7-6-8-11-20/h6-13,15,18,24H,5,14,16-17H2,1-4H3,(H,30,34)(H2,28,29,33)