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

Systemtic Name: 3-methyl-N-(2-methylquinolin-4-yl)-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-methyl-N-(2-methyl-4-quinolyl)pyrazole-4-sulfonamide CAS Name: 3-methyl-N-(2-methyl-4-quinolinyl)-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-methyl-N-(2-methylquinolin-4-yl)pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-methyl-N-(2-methyl-4-quinolyl)pyrazole-4-sulfonamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O2S/c1-15-12-20(18-10-6-7-11-19(18)22-15)24-28(26,27)21-14-25(23-16(21)2)13-17-8-4-3-5-9-17/h3-12,14H,13H2,1-2H3,(H,22,24)