ethyl 3-[(4-chlorophenyl)amino]-2-cyano-3-sulfanyl-prop-2-enoate

Systemtic Name: ethyl 3-[(4-chlorophenyl)amino]-2-cyano-3-sulfanyl-prop-2-enoate Openeye Name: ethyl 3-(4-chloroanilino)-2-cyano-3-sulfanyl-prop-2-enoate CAS Name: 3-(4-chloroanilino)-2-cyano-3-mercapto-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-(4-chloroanilino)-2-cyano-3-sulfanylprop-2-enoate Traditional Name: 3-(4-chloroanilino)-2-cyano-3-mercapto-acrylic acid ethyl ester Formula: C12H11ClN2O2S MolecularWeight: 282.74594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=CC=C(C=C1)Cl)S)C#N

Isomeric SMILES

CCOC(=O)C(=C(NC1=CC=C(C=C1)Cl)S)C#N

InChI

InChI=1S/C12H11ClN2O2S/c1-2-17-12(16)10(7-14)11(18)15-9-5-3-8(13)4-6-9/h3-6,15,18H,2H2,1H3