(E)-2-cyano-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-propoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-propoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydro-2-benzothiopyran-3-yl)-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-propoxyphenyl)acrylamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C3=C(CC(CC3)C)C(=S)S2)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C3=C(CC(CC3)C)C(=S)S2)C#N

InChI

InChI=1S/C24H23N3O2S2/c1-3-10-29-18-7-5-16(6-8-18)12-17(13-25)22(28)27-23-21(14-26)19-9-4-15(2)11-20(19)24(30)31-23/h5-8,12,15H,3-4,9-11H2,1-2H3,(H,27,28)/b17-12+