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

Systemtic Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-ethanamide Openeye Name: N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)-2-(4-methyl-2-oxo-chromen-7-yl)oxy-acetamide CAS Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydro-2-benzothiopyran-3-yl)-2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]acetamide IUPAC Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide Traditional Name: N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)-2-(2-keto-4-methyl-chromen-7-yl)oxy-acetamide Formula: C23H20N2O4S2 MolecularWeight: 452.5459

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=S)SC(=C2C#N)NC(=O)COC3=CC4=C(C=C3)C(=CC(=O)O4)C

Isomeric SMILES

CC1CCC2=C(C1)C(=S)SC(=C2C#N)NC(=O)COC3=CC4=C(C=C3)C(=CC(=O)O4)C

InChI

InChI=1S/C23H20N2O4S2/c1-12-3-5-16-17(7-12)23(30)31-22(18(16)10-24)25-20(26)11-28-14-4-6-15-13(2)8-21(27)29-19(15)9-14/h4,6,8-9,12H,3,5,7,11H2,1-2H3,(H,25,26)