3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanyl-thiophene-2-carboxylate

Systemtic Name: 3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanyl-thiophene-2-carboxylate Openeye Name: 3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanyl-thiophene-2-carboxylate CAS Name: 3-(4-chlorophenyl)-4-cyano-5-(cyclohexylthio)-2-thiophenecarboxylate IUPAC Name: 3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanylthiophene-2-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-cyano-5-(cyclohexylthio)-2-thenoate Formula: C18H15ClNO2S2- MolecularWeight: 376.9002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C(=C(S2)C(=O)[O-])C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1CCC(CC1)SC2=C(C(=C(S2)C(=O)[O-])C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C18H16ClNO2S2/c19-12-8-6-11(7-9-12)15-14(10-20)18(24-16(15)17(21)22)23-13-4-2-1-3-5-13/h6-9,13H,1-5H2,(H,21,22)/p-1