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

Systemtic Name: propan-2-yl 4-methyl-6-[3-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-6-[3-(3-methylbutanoylamino)phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-6-[3-[(3-methyl-1-oxobutyl)amino]phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-6-[3-(3-methylbutanoylamino)phenyl]-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(isovalerylamino)phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C23H33N3O4 MolecularWeight: 415.52582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O4/c1-7-11-26-16(6)20(22(28)30-15(4)5)21(25-23(26)29)17-9-8-10-18(13-17)24-19(27)12-14(2)3/h8-10,13-15,21H,7,11-12H2,1-6H3,(H,24,27)(H,25,29)