4-(4-chlorophenyl)-2-ethylsulfonyl-thiophene-3-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-2-ethylsulfonyl-thiophene-3-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-ethylsulfonyl-thiophene-3-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-ethylsulfonyl-3-thiophenecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-ethylsulfonylthiophene-3-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-esyl-thiophene-3-carbonitrile Formula: C13H10ClNO2S2 MolecularWeight: 311.807

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C(=CS1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCS(=O)(=O)C1=C(C(=CS1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C13H10ClNO2S2/c1-2-19(16,17)13-11(7-15)12(8-18-13)9-3-5-10(14)6-4-9/h3-6,8H,2H2,1H3