2,3,4,5,6-pentamethyl-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide

Systemtic Name: 2,3,4,5,6-pentamethyl-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide Openeye Name: 2,3,4,5,6-pentamethyl-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide CAS Name: 2,3,4,5,6-pentamethyl-N-[2-(1-phenyl-4-pyrazolyl)ethyl]benzenesulfonamide IUPAC Name: 2,3,4,5,6-pentamethyl-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide Traditional Name: 2,3,4,5,6-pentamethyl-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzenesulfonamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C22H27N3O2S/c1-15-16(2)18(4)22(19(5)17(15)3)28(26,27)24-12-11-20-13-23-25(14-20)21-9-7-6-8-10-21/h6-10,13-14,24H,11-12H2,1-5H3