methyl 2-methyl-1-oxidanylidene-isoquinoline-4-carbodithioate

Systemtic Name: methyl 2-methyl-1-oxidanylidene-isoquinoline-4-carbodithioate Openeye Name: methyl 2-methyl-1-oxo-isoquinoline-4-carbodithioate CAS Name: 2-methyl-1-oxo-4-isoquinolinecarbodithioic acid methyl ester IUPAC Name: methyl 2-methyl-1-oxoisoquinoline-4-carbodithioate Traditional Name: 1-keto-2-methyl-isoquinoline-4-carbodithioic acid methyl ester Formula: C12H11NOS2 MolecularWeight: 249.35184

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C2C1=O)C(=S)SC

Isomeric SMILES

CN1C=C(C2=CC=CC=C2C1=O)C(=S)SC

InChI

InChI=1S/C12H11NOS2/c1-13-7-10(12(15)16-2)8-5-3-4-6-9(8)11(13)14/h3-7H,1-2H3