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

Systemtic Name: propan-2-yl (6S)-6-[3-(butylcarbamoylamino)phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl (6S)-6-[3-(butylcarbamoylamino)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-[3-[[butylamino(oxo)methyl]amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6S)-6-[3-(butylcarbamoylamino)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-[3-(butylcarbamoylamino)phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C23H34N4O4 MolecularWeight: 430.54046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=CC(=C1)C2C(=C(N(C(=O)N2)CCC)C)C(=O)OC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H34N4O4/c1-6-8-12-24-22(29)25-18-11-9-10-17(14-18)20-19(21(28)31-15(3)4)16(5)27(13-7-2)23(30)26-20/h9-11,14-15,20H,6-8,12-13H2,1-5H3,(H,26,30)(H2,24,25,29)/t20-/m0/s1