3-(1-methyl-2-methylsulfanyl-6-oxidanylidene-7H-purin-8-yl)-1H-quinolin-2-one

Systemtic Name: 3-(1-methyl-2-methylsulfanyl-6-oxidanylidene-7H-purin-8-yl)-1H-quinolin-2-one Openeye Name: 3-(1-methyl-2-methylsulfanyl-6-oxo-7H-purin-8-yl)-1H-quinolin-2-one CAS Name: 3-[1-methyl-2-(methylthio)-6-oxo-7H-purin-8-yl]-1H-quinolin-2-one IUPAC Name: 3-(1-methyl-2-methylsulfanyl-6-oxo-7H-purin-8-yl)-1H-quinolin-2-one Traditional Name: 3-[6-keto-1-methyl-2-(methylthio)-7H-purin-8-yl]carbostyril Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2)C3=CC4=CC=CC=C4NC3=O)N=C1SC

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2)C3=CC4=CC=CC=C4NC3=O)N=C1SC

InChI

InChI=1S/C16H13N5O2S/c1-21-15(23)11-13(20-16(21)24-2)19-12(18-11)9-7-8-5-3-4-6-10(8)17-14(9)22/h3-7H,1-2H3,(H,17,22)(H,18,19)