(Z)-2-(4-chlorophenyl)carbonyl-3-(2,2-dimethoxyethylamino)-3-methylsulfanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-(4-chlorophenyl)carbonyl-3-(2,2-dimethoxyethylamino)-3-methylsulfanyl-prop-2-enenitrile Openeye Name: (Z)-2-(4-chlorobenzoyl)-3-(2,2-dimethoxyethylamino)-3-methylsulfanyl-prop-2-enenitrile CAS Name: (Z)-2-[(4-chlorophenyl)-oxomethyl]-3-(2,2-dimethoxyethylamino)-3-(methylthio)-2-propenenitrile IUPAC Name: (Z)-2-(4-chlorobenzoyl)-3-(2,2-dimethoxyethylamino)-3-methylsulfanylprop-2-enenitrile Traditional Name: (Z)-2-(4-chlorobenzoyl)-3-(2,2-dimethoxyethylamino)-3-(methylthio)acrylonitrile Formula: C15H17ClN2O3S MolecularWeight: 340.82508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=C(C#N)C(=O)C1=CC=C(C=C1)Cl)SC)OC

Isomeric SMILES

COC(CN/C(=C(\C#N)/C(=O)C1=CC=C(C=C1)Cl)/SC)OC

InChI

InChI=1S/C15H17ClN2O3S/c1-20-13(21-2)9-18-15(22-3)12(8-17)14(19)10-4-6-11(16)7-5-10/h4-7,13,18H,9H2,1-3H3/b15-12-