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

Systemtic Name: ethyl 6-[3-(butanoylamino)phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-(butanoylamino)phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 2-oxo-6-[3-(1-oxobutylamino)phenyl]-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(butanoylamino)phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-butyramidophenyl)-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=O)N2)CCC)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=O)N2)CCC)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C26H31N3O4/c1-4-11-21(30)27-20-15-10-14-19(17-20)23-22(25(31)33-6-3)24(18-12-8-7-9-13-18)29(16-5-2)26(32)28-23/h7-10,12-15,17,23H,4-6,11,16H2,1-3H3,(H,27,30)(H,28,32)