(E)-2-cyano-3-[3-methoxy-5-[(4-methylphenyl)sulfanylmethyl]-4-oxidanyl-phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-methoxy-5-[(4-methylphenyl)sulfanylmethyl]-4-oxidanyl-phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-hydroxy-3-methoxy-5-(p-tolylsulfanylmethyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-[4-hydroxy-3-methoxy-5-[[(4-methylphenyl)thio]methyl]phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-hydroxy-3-methoxy-5-[(4-methylphenyl)sulfanylmethyl]phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-hydroxy-3-methoxy-5-[(p-tolylthio)methyl]phenyl]acrylamide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=C(C(=CC(=C2)C=C(C#N)C(=O)N)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=C(C(=CC(=C2)/C=C(\C#N)/C(=O)N)OC)O

InChI

InChI=1S/C19H18N2O3S/c1-12-3-5-16(6-4-12)25-11-15-8-13(7-14(10-20)19(21)23)9-17(24-2)18(15)22/h3-9,22H,11H2,1-2H3,(H2,21,23)/b14-7+