(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-allyloxy-3-methoxy-phenyl)-N-[4-(3-pyridylmethylsulfanyl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-N-[4-(3-pyridinylmethylthio)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-allyloxy-3-methoxy-phenyl)-N-[4-(3-pyridylmethylthio)phenyl]acrylamide Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)OCC=C

InChI

InChI=1S/C25H24N2O3S/c1-3-15-30-23-12-6-19(16-24(23)29-2)7-13-25(28)27-21-8-10-22(11-9-21)31-18-20-5-4-14-26-17-20/h3-14,16-17H,1,15,18H2,2H3,(H,27,28)/b13-7+