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

Systemtic Name: propan-2-yl 4-methyl-2-oxidanylidene-6-[4-(propanoylamino)phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-2-oxo-6-[4-(propanoylamino)phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[4-(1-oxopropylamino)phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-2-oxo-6-[4-(propanoylamino)phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-4-methyl-6-(4-propionamidophenyl)-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O4/c1-6-12-24-14(5)18(20(26)28-13(3)4)19(23-21(24)27)15-8-10-16(11-9-15)22-17(25)7-2/h8-11,13,19H,6-7,12H2,1-5H3,(H,22,25)(H,23,27)