ethyl (6R)-3,4-dimethyl-2-oxidanylidene-6-[3-(3-phenylpropanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6R)-3,4-dimethyl-2-oxidanylidene-6-[3-(3-phenylpropanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6R)-3,4-dimethyl-2-oxo-6-[3-(3-phenylpropanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3,4-dimethyl-2-oxo-6-[3-[(1-oxo-3-phenylpropyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-3,4-dimethyl-2-oxo-6-[3-(3-phenylpropanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-[3-(hydrocinnamoylamino)phenyl]-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)NC(=O)CCC3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N[C@@H]1C2=CC(=CC=C2)NC(=O)CCC3=CC=CC=C3)C)C

InChI

InChI=1S/C24H27N3O4/c1-4-31-23(29)21-16(2)27(3)24(30)26-22(21)18-11-8-12-19(15-18)25-20(28)14-13-17-9-6-5-7-10-17/h5-12,15,22H,4,13-14H2,1-3H3,(H,25,28)(H,26,30)/t22-/m1/s1