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N-(4-cyano-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enamide

N-(4-cyano-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enamide

Systemtic Name:N-(4-cyano-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enamide
Openeye Name:N-(4-cyano-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-isopentyloxy-3-methoxy-phenyl)prop-2-enamide
CAS Name:N-(4-cyano-1-sulfanylidene-5,6,7,8-tetrahydro-2-benzothiopyran-3-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-2-propenamide
IUPAC Name:N-(4-cyano-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enamide
Traditional Name:N-(4-cyano-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)-3-(4-isoamoxy-3-methoxy-phenyl)acrylamide
Formula: C25H28N2O3S2
MolecularWeight: 468.63142
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C3=C(CCCC3)C(=S)S2)C#N)OC


Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C3=C(CCCC3)C(=S)S2)C#N)OC


InChI

InChI=1S/C25H28N2O3S2/c1-16(2)12-13-30-21-10-8-17(14-22(21)29-3)9-11-23(28)27-24-20(15-26)18-6-4-5-7-19(18)25(31)32-24/h8-11,14,16H,4-7,12-13H2,1-3H3,(H,27,28)


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