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

Systemtic Name: ethyl 3-butyl-2-oxidanylidene-6-[3-(pentanoylamino)phenyl]-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-2-oxo-6-[3-(pentanoylamino)phenyl]-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-2-oxo-6-[3-(1-oxopentylamino)phenyl]-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-2-oxo-6-[3-(pentanoylamino)phenyl]-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-2-keto-4-phenyl-6-[3-(valerylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O4/c1-4-7-17-23(32)29-22-16-12-15-21(19-22)25-24(27(33)35-6-3)26(20-13-10-9-11-14-20)31(18-8-5-2)28(34)30-25/h9-16,19,25H,4-8,17-18H2,1-3H3,(H,29,32)(H,30,34)