(Z)-2-cyano-3-[3-methoxy-4-oxidanyl-5-(3-phenylpropylsulfanylmethyl)phenyl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-[3-methoxy-4-oxidanyl-5-(3-phenylpropylsulfanylmethyl)phenyl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (Z)-N-benzyl-2-cyano-3-[4-hydroxy-3-methoxy-5-(3-phenylpropylsulfanylmethyl)phenyl]prop-2-enamide CAS Name: (Z)-2-cyano-3-[4-hydroxy-3-methoxy-5-[(3-phenylpropylthio)methyl]phenyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: (Z)-N-benzyl-2-cyano-3-[4-hydroxy-3-methoxy-5-(3-phenylpropylsulfanylmethyl)phenyl]prop-2-enamide Traditional Name: (Z)-N-benzyl-2-cyano-3-[4-hydroxy-3-methoxy-5-[(3-phenylpropylthio)methyl]phenyl]acrylamide Formula: C28H28N2O3S MolecularWeight: 472.59852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CSCCCC2=CC=CC=C2)C=C(C#N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1O)CSCCCC2=CC=CC=C2)/C=C(/C#N)\C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C28H28N2O3S/c1-33-26-17-23(15-24(18-29)28(32)30-19-22-11-6-3-7-12-22)16-25(27(26)31)20-34-14-8-13-21-9-4-2-5-10-21/h2-7,9-12,15-17,31H,8,13-14,19-20H2,1H3,(H,30,32)/b24-15-