3-tert-butyl-N-(4-methyl-1,3-thiazol-2-yl)-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-(4-methyl-1,3-thiazol-2-yl)-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-(4-methylthiazol-2-yl)pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-(4-methyl-2-thiazolyl)-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-(4-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-(4-methylthiazol-2-yl)pyrazole-4-sulfonamide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NS(=O)(=O)C2=CN(N=C2C(C)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CSC(=N1)NS(=O)(=O)C2=CN(N=C2C(C)(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O2S2/c1-13-12-25-17(19-13)21-26(23,24)15-11-22(20-16(15)18(2,3)4)10-14-8-6-5-7-9-14/h5-9,11-12H,10H2,1-4H3,(H,19,21)