3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)pyrazole-4-sulfonamide

Systemtic Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide CAS Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-4-sulfonamide Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CN(N=C3C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CN(N=C3C)CC4=CC=CC=C4

InChI

InChI=1S/C19H18N4O2S2/c1-13-8-9-16-17(10-13)26-19(20-16)22-27(24,25)18-12-23(21-14(18)2)11-15-6-4-3-5-7-15/h3-10,12H,11H2,1-2H3,(H,20,22)