N-(2-ethyl-6-methyl-phenyl)-2-[[9-(4-methylphenyl)-6-oxidanylidene-3H-purin-8-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[[9-(4-methylphenyl)-6-oxidanylidene-3H-purin-8-yl]sulfanyl]ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[[6-oxo-9-(p-tolyl)-3H-purin-8-yl]sulfanyl]acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[[9-(4-methylphenyl)-6-oxo-3H-purin-8-yl]thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-[[9-(4-methylphenyl)-6-oxo-3H-purin-8-yl]sulfanyl]acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[[6-keto-9-(p-tolyl)-3H-purin-8-yl]thio]acetamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(N2C4=CC=C(C=C4)C)NC=NC3=O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(N2C4=CC=C(C=C4)C)NC=NC3=O)C

InChI

InChI=1S/C23H23N5O2S/c1-4-16-7-5-6-15(3)19(16)26-18(29)12-31-23-27-20-21(24-13-25-22(20)30)28(23)17-10-8-14(2)9-11-17/h5-11,13H,4,12H2,1-3H3,(H,26,29)(H,24,25,30)