3-tert-butyl-N-(2-ethoxyphenyl)-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-(2-ethoxyphenyl)-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-(2-ethoxyphenyl)pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-(2-ethoxyphenyl)-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-(2-ethoxyphenyl)pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-o-phenetyl-pyrazole-4-sulfonamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NS(=O)(=O)C2=CN(N=C2C(C)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NS(=O)(=O)C2=CN(N=C2C(C)(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-5-28-19-14-10-9-13-18(19)24-29(26,27)20-16-25(23-21(20)22(2,3)4)15-17-11-7-6-8-12-17/h6-14,16,24H,5,15H2,1-4H3