N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-2-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-2-methylsulfonyl-benzenesulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-2-methylsulfonyl-benzenesulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-pyrazolyl]-2-methylsulfonylbenzenesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-2-methylsulfonylbenzenesulfonamide Traditional Name: N-[1-(3-cyanobenzyl)pyrazol-4-yl]-2-mesyl-benzenesulfonamide Formula: C18H16N4O4S2 MolecularWeight: 416.47404

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=CN(N=C2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H16N4O4S2/c1-27(23,24)17-7-2-3-8-18(17)28(25,26)21-16-11-20-22(13-16)12-15-6-4-5-14(9-15)10-19/h2-9,11,13,21H,12H2,1H3