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

Systemtic Name: 3-tert-butyl-N-(2-methylquinolin-4-yl)-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-(2-methyl-4-quinolyl)pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-(2-methyl-4-quinolinyl)-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-(2-methylquinolin-4-yl)pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-(2-methyl-4-quinolyl)pyrazole-4-sulfonamide Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CN(N=C3C(C)(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CN(N=C3C(C)(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2S/c1-17-14-21(19-12-8-9-13-20(19)25-17)27-31(29,30)22-16-28(26-23(22)24(2,3)4)15-18-10-6-5-7-11-18/h5-14,16H,15H2,1-4H3,(H,25,27)