3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanyl-thiophene-2-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanyl-thiophene-2-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanyl-thiophene-2-carboxylic acid CAS Name: 3-(4-chlorophenyl)-4-cyano-5-(cyclohexylthio)-2-thiophenecarboxylic acid IUPAC Name: 3-(4-chlorophenyl)-4-cyano-5-cyclohexylsulfanylthiophene-2-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-4-cyano-5-(cyclohexylthio)-2-thenoic acid Formula: C18H16ClNO2S2 MolecularWeight: 377.90814

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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)