ethyl (6S)-6-(4-aminophenyl)-3-ethyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-6-(4-aminophenyl)-3-ethyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-6-(4-aminophenyl)-3-ethyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(4-aminophenyl)-3-ethyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-6-(4-aminophenyl)-3-ethyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(4-aminophenyl)-3-ethyl-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)N)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=C([C@@H](NC1=O)C2=CC=C(C=C2)N)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3/c1-3-24-19(15-8-6-5-7-9-15)17(20(25)27-4-2)18(23-21(24)26)14-10-12-16(22)13-11-14/h5-13,18H,3-4,22H2,1-2H3,(H,23,26)/t18-/m0/s1