N-(2-cyanoethyl)-N-methyl-3-phenyl-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-3-phenyl-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-(2-cyanoethyl)-N-methyl-3-phenyl-pyrazole-4-sulfonamide CAS Name: N-(2-cyanoethyl)-N-methyl-3-phenyl-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-(2-cyanoethyl)-N-methyl-3-phenylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(2-cyanoethyl)-N-methyl-3-phenyl-pyrazole-4-sulfonamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)S(=O)(=O)C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CN(CCC#N)S(=O)(=O)C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O2S/c1-23(14-8-13-21)27(25,26)19-16-24(15-17-9-4-2-5-10-17)22-20(19)18-11-6-3-7-12-18/h2-7,9-12,16H,8,14-15H2,1H3