(E)-2-cyano-3-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]-N-(oxolan-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]-N-(oxolan-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(2-furylmethylsulfanylmethyl)-4-methoxy-phenyl]-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-[(2-furanylmethylthio)methyl]-4-methoxyphenyl]-N-(2-oxolanylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxyphenyl]-N-(oxolan-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-[(2-furfurylthio)methyl]-4-methoxy-phenyl]-N-(tetrahydrofurfuryl)acrylamide Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NCC2CCCO2)CSCC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCC2CCCO2)CSCC3=CC=CO3

InChI

InChI=1S/C22H24N2O4S/c1-26-21-7-6-16(11-18(21)14-29-15-20-5-3-9-28-20)10-17(12-23)22(25)24-13-19-4-2-8-27-19/h3,5-7,9-11,19H,2,4,8,13-15H2,1H3,(H,24,25)/b17-10+