ethyl (6R)-3-butyl-4-methyl-2-oxidanylidene-6-[4-(propanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)CC)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C([C@H](NC1=O)C2=CC=C(C=C2)NC(=O)CC)C(=O)OCC)C

InChI

InChI=1S/C21H29N3O4/c1-5-8-13-24-14(4)18(20(26)28-7-3)19(23-21(24)27)15-9-11-16(12-10-15)22-17(25)6-2/h9-12,19H,5-8,13H2,1-4H3,(H,22,25)(H,23,27)/t19-/m1/s1