4-[5-cyano-1-(cyanomethyl)-4-(4-methylphenyl)pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[5-cyano-1-(cyanomethyl)-4-(4-methylphenyl)pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[5-cyano-1-(cyanomethyl)-4-(p-tolyl)pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[5-cyano-1-(cyanomethyl)-4-(4-methylphenyl)-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-cyano-1-(cyanomethyl)-4-(4-methylphenyl)pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[5-cyano-1-(cyanomethyl)-4-(p-tolyl)pyrazol-3-yl]benzenesulfonamide Formula: C19H15N5O2S MolecularWeight: 377.4197

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CC#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CC#N)C#N

InChI

InChI=1S/C19H15N5O2S/c1-13-2-4-14(5-3-13)18-17(12-21)24(11-10-20)23-19(18)15-6-8-16(9-7-15)27(22,25)26/h2-9H,11H2,1H3,(H2,22,25,26)