(E)-2-cyano-3-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(2-furylmethylsulfanylmethyl)-4-methoxy-phenyl]-N-(4-phenylthiazol-2-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-[(2-furanylmethylthio)methyl]-4-methoxyphenyl]-N-(4-phenyl-2-thiazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxyphenyl]-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-[(2-furfurylthio)methyl]-4-methoxy-phenyl]-N-(4-phenylthiazol-2-yl)acrylamide Formula: C26H21N3O3S2 MolecularWeight: 487.59324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC=CC=C3)CSCC4=CC=CO4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC=CC=C3)CSCC4=CC=CO4

InChI

InChI=1S/C26H21N3O3S2/c1-31-24-10-9-18(13-21(24)15-33-16-22-8-5-11-32-22)12-20(14-27)25(30)29-26-28-23(17-34-26)19-6-3-2-4-7-19/h2-13,17H,15-16H2,1H3,(H,28,29,30)/b20-12+