(E)-N-[2-(4-hydroxyphenyl)ethyl]-3-(4-methoxy-3-pentylsulfanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-hydroxyphenyl)ethyl]-3-(4-methoxy-3-pentylsulfanyl-phenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-hydroxyphenyl)ethyl]-3-(4-methoxy-3-pentylsulfanyl-phenyl)prop-2-enamide CAS Name: (E)-N-[2-(4-hydroxyphenyl)ethyl]-3-[4-methoxy-3-(pentylthio)phenyl]-2-propenamide IUPAC Name: (E)-N-[2-(4-hydroxyphenyl)ethyl]-3-(4-methoxy-3-pentylsulfanylphenyl)prop-2-enamide Traditional Name: (E)-3-[3-(amylthio)-4-methoxy-phenyl]-N-[2-(4-hydroxyphenyl)ethyl]acrylamide Formula: C23H29NO3S MolecularWeight: 399.54626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)OC

Isomeric SMILES

CCCCCSC1=C(C=CC(=C1)/C=C/C(=O)NCCC2=CC=C(C=C2)O)OC

InChI

InChI=1S/C23H29NO3S/c1-3-4-5-16-28-22-17-19(8-12-21(22)27-2)9-13-23(26)24-15-14-18-6-10-20(25)11-7-18/h6-13,17,25H,3-5,14-16H2,1-2H3,(H,24,26)/b13-9+