2-chloranyl-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)ethanamide

Systemtic Name: 2-chloranyl-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)ethanamide Openeye Name: 2-chloro-N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)acetamide CAS Name: 2-chloro-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydro-2-benzothiopyran-3-yl)acetamide IUPAC Name: 2-chloro-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)acetamide Traditional Name: 2-chloro-N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)acetamide Formula: C13H13ClN2OS2 MolecularWeight: 312.83812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=S)SC(=C2C#N)NC(=O)CCl

Isomeric SMILES

CC1CCC2=C(C1)C(=S)SC(=C2C#N)NC(=O)CCl

InChI

InChI=1S/C13H13ClN2OS2/c1-7-2-3-8-9(4-7)13(18)19-12(10(8)6-15)16-11(17)5-14/h7H,2-5H2,1H3,(H,16,17)