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

Systemtic Name: 2-methylpropyl 4-methyl-6-[3-[(4-methylphenyl)carbonylamino]phenyl]-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 4-methyl-6-[3-[(4-methylbenzoyl)amino]phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-6-[3-[[(4-methylphenyl)-oxomethyl]amino]phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-methyl-6-[3-[(4-methylbenzoyl)amino]phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-4-methyl-3-propyl-6-[3-(p-toluoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33N3O4/c1-6-14-30-19(5)23(26(32)34-16-17(2)3)24(29-27(30)33)21-8-7-9-22(15-21)28-25(31)20-12-10-18(4)11-13-20/h7-13,15,17,24H,6,14,16H2,1-5H3,(H,28,31)(H,29,33)