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

Systemtic Name: methyl 4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-6-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(isobutyrylamino)phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C(C)C)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C(C)C)C(=O)OC)C

InChI

InChI=1S/C20H27N3O4/c1-6-10-23-13(4)16(19(25)27-5)17(22-20(23)26)14-8-7-9-15(11-14)21-18(24)12(2)3/h7-9,11-12,17H,6,10H2,1-5H3,(H,21,24)(H,22,26)