N-(3-chlorophenyl)-4-cyano-5-methylsulfanyl-3-oxidanylidene-1,2-thiazole-2-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-cyano-5-methylsulfanyl-3-oxidanylidene-1,2-thiazole-2-carboxamide Openeye Name: N-(3-chlorophenyl)-4-cyano-5-methylsulfanyl-3-oxo-isothiazole-2-carboxamide CAS Name: N-(3-chlorophenyl)-4-cyano-5-(methylthio)-3-oxo-2-isothiazolecarboxamide IUPAC Name: N-(3-chlorophenyl)-4-cyano-5-methylsulfanyl-3-oxo-1,2-thiazole-2-carboxamide Traditional Name: N-(3-chlorophenyl)-4-cyano-3-keto-5-(methylthio)-4-isothiazoline-2-carboxamide Formula: C12H8ClN3O2S2 MolecularWeight: 325.79382

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N(S1)C(=O)NC2=CC(=CC=C2)Cl)C#N

Isomeric SMILES

CSC1=C(C(=O)N(S1)C(=O)NC2=CC(=CC=C2)Cl)C#N

InChI

InChI=1S/C12H8ClN3O2S2/c1-19-11-9(6-14)10(17)16(20-11)12(18)15-8-4-2-3-7(13)5-8/h2-5H,1H3,(H,15,18)