2-(3-methylphenyl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide

Systemtic Name: 2-(3-methylphenyl)-8-oxidanylidene-9-thiophen-2-yl-7H-purine-6-carboxamide Openeye Name: 2-(m-tolyl)-8-oxo-9-(2-thienyl)-7H-purine-6-carboxamide CAS Name: 2-(3-methylphenyl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide IUPAC Name: 2-(3-methylphenyl)-8-oxo-9-thiophen-2-yl-7H-purine-6-carboxamide Traditional Name: 8-keto-2-(m-tolyl)-9-(2-thienyl)-7H-purine-6-carboxamide Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=CS4)C(=O)N

InChI

InChI=1S/C17H13N5O2S/c1-9-4-2-5-10(8-9)15-19-12(14(18)23)13-16(21-15)22(17(24)20-13)11-6-3-7-25-11/h2-8H,1H3,(H2,18,23)(H,20,24)