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

Systemtic Name: (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-[(2-methylphenyl)amino]prop-2-enamide Openeye Name: (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-(2-methylanilino)prop-2-enamide CAS Name: (E)-3-[(4-chlorophenyl)methylthio]-2-cyano-3-(2-methylanilino)-2-propenamide IUPAC Name: (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-3-(2-methylanilino)prop-2-enamide Traditional Name: (E)-3-[(4-chlorobenzyl)thio]-2-cyano-3-(o-toluidino)acrylamide Formula: C18H16ClN3OS MolecularWeight: 357.85714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=C(C#N)C(=O)N)SCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=CC=C1N/C(=C(/C#N)\C(=O)N)/SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H16ClN3OS/c1-12-4-2-3-5-16(12)22-18(15(10-20)17(21)23)24-11-13-6-8-14(19)9-7-13/h2-9,22H,11H2,1H3,(H2,21,23)/b18-15+