3-methyl-8-phenyl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 3-methyl-8-phenyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 3-methyl-8-phenyl-6-thioxo-7H-purin-2-one CAS Name: 3-methyl-8-phenyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 3-methyl-8-phenyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 3-methyl-8-phenyl-6-thioxo-7H-purin-2-one Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=S)NC1=O)NC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=S)NC1=O)NC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C12H10N4OS/c1-16-10-8(11(18)15-12(16)17)13-9(14-10)7-5-3-2-4-6-7/h2-6H,1H3,(H,13,14)(H,15,17,18)