4-[1-(cyanomethyl)-4-phenyl-pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[1-(cyanomethyl)-4-phenyl-pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[1-(cyanomethyl)-4-phenyl-pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[1-(cyanomethyl)-4-phenyl-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[1-(cyanomethyl)-4-phenylpyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[1-(cyanomethyl)-4-phenyl-pyrazol-3-yl]benzenesulfonamide Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O2S/c18-10-11-21-12-16(13-4-2-1-3-5-13)17(20-21)14-6-8-15(9-7-14)24(19,22)23/h1-9,12H,11H2,(H2,19,22,23)