2-[[9-methyl-2,6-bis(oxidanylidene)-3H-purin-8-yl]sulfanyl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[[9-methyl-2,6-bis(oxidanylidene)-3H-purin-8-yl]sulfanyl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[(9-methyl-2,6-dioxo-3H-purin-8-yl)sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[(9-methyl-2,6-dioxo-3H-purin-8-yl)thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[(9-methyl-2,6-dioxo-3H-purin-8-yl)sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[(2,6-diketo-9-methyl-3H-purin-8-yl)thio]-N-(m-tolyl)acetamide Formula: C15H15N5O3S MolecularWeight: 345.3763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(N2C)NC(=O)NC3=O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(N2C)NC(=O)NC3=O

InChI

InChI=1S/C15H15N5O3S/c1-8-4-3-5-9(6-8)16-10(21)7-24-15-17-11-12(20(15)2)18-14(23)19-13(11)22/h3-6H,7H2,1-2H3,(H,16,21)(H2,18,19,22,23)