N-(2,6-dimethylphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-(2,6-dimethylphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-(2,6-dimethylphenyl)-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-(2,6-dimethylphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-(2,6-dimethylphenyl)-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(2,6-dimethylphenyl)-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S2/c1-16-8-6-9-17(2)21(16)24-29(26,27)20-15-25(14-18-10-4-3-5-11-18)23-22(20)19-12-7-13-28-19/h3-13,15,24H,14H2,1-2H3