N-(4-bromophenyl)-2-[[5-[(4-methylphenyl)methyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[5-[(4-methylphenyl)methyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[[4-hydroxy-6-oxo-5-(p-tolylmethyl)-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[[4-hydroxy-5-[(4-methylphenyl)methyl]-6-oxo-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[[4-hydroxy-5-[(4-methylphenyl)methyl]-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: N-(4-bromophenyl)-2-[[4-hydroxy-6-keto-5-(4-methylbenzyl)-1H-pyrimidin-2-yl]thio]acetamide Formula: C20H18BrN3O3S MolecularWeight: 460.34422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC(=O)NC3=CC=C(C=C3)Br)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC(=O)NC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C20H18BrN3O3S/c1-12-2-4-13(5-3-12)10-16-18(26)23-20(24-19(16)27)28-11-17(25)22-15-8-6-14(21)7-9-15/h2-9H,10-11H2,1H3,(H,22,25)(H2,23,24,26,27)