propan-2-yl (6S)-3-butyl-4-methyl-2-oxidanylidene-6-[3-(pentanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl (6S)-3-butyl-4-methyl-2-oxidanylidene-6-[3-(pentanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl (6S)-3-butyl-4-methyl-2-oxo-6-[3-(pentanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-butyl-4-methyl-2-oxo-6-[3-(1-oxopentylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6S)-3-butyl-4-methyl-2-oxo-6-[3-(pentanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-butyl-2-keto-4-methyl-6-[3-(valerylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C24H35N3O4 MolecularWeight: 429.5524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC(=O)NC1=CC=CC(=C1)[C@H]2C(=C(N(C(=O)N2)CCCC)C)C(=O)OC(C)C

InChI

InChI=1S/C24H35N3O4/c1-6-8-13-20(28)25-19-12-10-11-18(15-19)22-21(23(29)31-16(3)4)17(5)27(14-9-7-2)24(30)26-22/h10-12,15-16,22H,6-9,13-14H2,1-5H3,(H,25,28)(H,26,30)/t22-/m0/s1