N-(3-chloranyl-2-methyl-phenyl)-2-[(5-ethyl-4-oxidanyl-6-oxidanylidene-3-phenyl-1,2-dihydropyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[(5-ethyl-4-oxidanyl-6-oxidanylidene-3-phenyl-1,2-dihydropyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[(5-ethyl-4-hydroxy-6-oxo-3-phenyl-1,2-dihydropyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(5-ethyl-4-hydroxy-6-oxo-3-phenyl-1,2-dihydropyrimidin-2-yl)thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[(5-ethyl-4-hydroxy-6-oxo-3-phenyl-1,2-dihydropyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(5-ethyl-4-hydroxy-6-keto-3-phenyl-1,2-dihydropyrimidin-2-yl)thio]acetamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(NC1=O)SCC(=O)NC2=C(C(=CC=C2)Cl)C)C3=CC=CC=C3)O

Isomeric SMILES

CCC1=C(N(C(NC1=O)SCC(=O)NC2=C(C(=CC=C2)Cl)C)C3=CC=CC=C3)O

InChI

InChI=1S/C21H22ClN3O3S/c1-3-15-19(27)24-21(25(20(15)28)14-8-5-4-6-9-14)29-12-18(26)23-17-11-7-10-16(22)13(17)2/h4-11,21,28H,3,12H2,1-2H3,(H,23,26)(H,24,27)