(E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-[(4-ethoxyphenyl)amino]prop-2-enamide

Systemtic Name: (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-[(4-ethoxyphenyl)amino]prop-2-enamide Openeye Name: (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-(4-ethoxyanilino)prop-2-enamide CAS Name: (E)-3-[(4-chlorophenyl)methylthio]-2-cyano-3-(4-ethoxyanilino)-2-propenamide IUPAC Name: (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-(4-ethoxyanilino)prop-2-enamide Traditional Name: (E)-3-[(4-chlorobenzyl)thio]-2-cyano-3-(p-phenetidino)acrylamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=C(C#N)C(=O)N)SCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N/C(=C(/C#N)\C(=O)N)/SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-2-25-16-9-7-15(8-10-16)23-19(17(11-21)18(22)24)26-12-13-3-5-14(20)6-4-13/h3-10,23H,2,12H2,1H3,(H2,22,24)/b19-17+