(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[2-(phenylmethylsulfanyl)ethyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[2-(phenylmethylsulfanyl)ethyl]prop-2-enamide Openeye Name: (E)-N-(2-benzylsulfanylethyl)-3-(5-bromo-2-methoxy-phenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[2-(phenylmethylthio)ethyl]-2-propenamide IUPAC Name: (E)-N-(2-benzylsulfanylethyl)-3-(5-bromo-2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(benzylthio)ethyl]-3-(5-bromo-2-methoxy-phenyl)acrylamide Formula: C19H20BrNO2S MolecularWeight: 406.3366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C19H20BrNO2S/c1-23-18-9-8-17(20)13-16(18)7-10-19(22)21-11-12-24-14-15-5-3-2-4-6-15/h2-10,13H,11-12,14H2,1H3,(H,21,22)/b10-7+