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

Systemtic Name: (E)-3-[3-[(2-chlorophenyl)methylsulfanylmethyl]-5-methoxy-4-oxidanyl-phenyl]-2-cyano-prop-2-enamide Openeye Name: (E)-3-[3-[(2-chlorophenyl)methylsulfanylmethyl]-4-hydroxy-5-methoxy-phenyl]-2-cyano-prop-2-enamide CAS Name: (E)-3-[3-[[(2-chlorophenyl)methylthio]methyl]-4-hydroxy-5-methoxyphenyl]-2-cyano-2-propenamide IUPAC Name: (E)-3-[3-[(2-chlorophenyl)methylsulfanylmethyl]-4-hydroxy-5-methoxyphenyl]-2-cyanoprop-2-enamide Traditional Name: (E)-3-[3-[[(2-chlorobenzyl)thio]methyl]-4-hydroxy-5-methoxy-phenyl]-2-cyano-acrylamide Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CSCC2=CC=CC=C2Cl)C=C(C#N)C(=O)N

Isomeric SMILES

COC1=CC(=CC(=C1O)CSCC2=CC=CC=C2Cl)/C=C(\C#N)/C(=O)N

InChI

InChI=1S/C19H17ClN2O3S/c1-25-17-8-12(6-14(9-21)19(22)24)7-15(18(17)23)11-26-10-13-4-2-3-5-16(13)20/h2-8,23H,10-11H2,1H3,(H2,22,24)/b14-6+