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

Systemtic Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)butanamide Openeye Name: N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)butanamide CAS Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydro-2-benzothiopyran-3-yl)butanamide IUPAC Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)butanamide Traditional Name: N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)butyramide Formula: C15H18N2OS2 MolecularWeight: 306.44622

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C2=C(CC(CC2)C)C(=S)S1)C#N

Isomeric SMILES

CCCC(=O)NC1=C(C2=C(CC(CC2)C)C(=S)S1)C#N

InChI

InChI=1S/C15H18N2OS2/c1-3-4-13(18)17-14-12(8-16)10-6-5-9(2)7-11(10)15(19)20-14/h9H,3-7H2,1-2H3,(H,17,18)