3-[(4-methylphenyl)sulfonylmethyl]thiophene-2-carbonitrile

Systemtic Name: 3-[(4-methylphenyl)sulfonylmethyl]thiophene-2-carbonitrile Openeye Name: 3-(p-tolylsulfonylmethyl)thiophene-2-carbonitrile CAS Name: 3-[(4-methylphenyl)sulfonylmethyl]-2-thiophenecarbonitrile IUPAC Name: 3-[(4-methylphenyl)sulfonylmethyl]thiophene-2-carbonitrile Traditional Name: 3-(tosylmethyl)thiophene-2-carbonitrile Formula: C13H11NO2S2 MolecularWeight: 277.36194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(SC=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=C(SC=C2)C#N

InChI

InChI=1S/C13H11NO2S2/c1-10-2-4-12(5-3-10)18(15,16)9-11-6-7-17-13(11)8-14/h2-7H,9H2,1H3