(E)-2-(2-chlorophenyl)carbonyl-3-[(4-fluorophenyl)amino]-3-methylsulfanyl-prop-2-enenitrile

Systemtic Name: (E)-2-(2-chlorophenyl)carbonyl-3-[(4-fluorophenyl)amino]-3-methylsulfanyl-prop-2-enenitrile Openeye Name: (E)-2-(2-chlorobenzoyl)-3-(4-fluoroanilino)-3-methylsulfanyl-prop-2-enenitrile CAS Name: (E)-2-[(2-chlorophenyl)-oxomethyl]-3-(4-fluoroanilino)-3-(methylthio)-2-propenenitrile IUPAC Name: (E)-2-(2-chlorobenzoyl)-3-(4-fluoroanilino)-3-methylsulfanylprop-2-enenitrile Traditional Name: (E)-2-(2-chlorobenzoyl)-3-(4-fluoroanilino)-3-(methylthio)acrylonitrile Formula: C17H12ClFN2OS MolecularWeight: 346.806383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C(=O)C1=CC=CC=C1Cl)NC2=CC=C(C=C2)F

Isomeric SMILES

CS/C(=C(\C#N)/C(=O)C1=CC=CC=C1Cl)/NC2=CC=C(C=C2)F

InChI

InChI=1S/C17H12ClFN2OS/c1-23-17(21-12-8-6-11(19)7-9-12)14(10-20)16(22)13-4-2-3-5-15(13)18/h2-9,21H,1H3/b17-14+