3,5-dimethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-1H-pyrazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-1H-pyrazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]-1H-pyrazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-1H-pyrazole-4-sulfonamide IUPAC Name: 3,5-dimethyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-1H-pyrazole-4-sulfonamide Traditional Name: 3,5-dimethyl-N-[2-(2-thienyl)-2-tosyl-ethyl]-1H-pyrazole-4-sulfonamide Formula: C18H21N3O4S3 MolecularWeight: 439.57204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNS(=O)(=O)C2=C(NN=C2C)C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNS(=O)(=O)C2=C(NN=C2C)C)C3=CC=CS3

InChI

InChI=1S/C18H21N3O4S3/c1-12-6-8-15(9-7-12)27(22,23)17(16-5-4-10-26-16)11-19-28(24,25)18-13(2)20-21-14(18)3/h4-10,17,19H,11H2,1-3H3,(H,20,21)