N-methyl-2-[3-methyl-7-[(4-methylphenyl)methyl]-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-ethanamide

Systemtic Name: N-methyl-2-[3-methyl-7-[(4-methylphenyl)methyl]-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-ethanamide Openeye Name: N-methyl-2-[3-methyl-2,6-dioxo-7-(p-tolylmethyl)purin-8-yl]sulfanyl-acetamide CAS Name: N-methyl-2-[[3-methyl-7-[(4-methylphenyl)methyl]-2,6-dioxo-8-purinyl]thio]acetamide IUPAC Name: N-methyl-2-[3-methyl-7-[(4-methylphenyl)methyl]-2,6-dioxopurin-8-yl]sulfanylacetamide Traditional Name: 2-[[2,6-diketo-3-methyl-7-(4-methylbenzyl)purin-8-yl]thio]-N-methyl-acetamide Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(N=C2SCC(=O)NC)N(C(=O)NC3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(N=C2SCC(=O)NC)N(C(=O)NC3=O)C

InChI

InChI=1S/C17H19N5O3S/c1-10-4-6-11(7-5-10)8-22-13-14(21(3)16(25)20-15(13)24)19-17(22)26-9-12(23)18-2/h4-7H,8-9H2,1-3H3,(H,18,23)(H,20,24,25)