1-cyclopentyl-N-(3-methylsulfanylphenyl)-3-phenyl-pyrazole-4-sulfonamide

Systemtic Name: 1-cyclopentyl-N-(3-methylsulfanylphenyl)-3-phenyl-pyrazole-4-sulfonamide Openeye Name: 1-cyclopentyl-N-(3-methylsulfanylphenyl)-3-phenyl-pyrazole-4-sulfonamide CAS Name: 1-cyclopentyl-N-[3-(methylthio)phenyl]-3-phenyl-4-pyrazolesulfonamide IUPAC Name: 1-cyclopentyl-N-(3-methylsulfanylphenyl)-3-phenylpyrazole-4-sulfonamide Traditional Name: 1-cyclopentyl-N-[3-(methylthio)phenyl]-3-phenyl-pyrazole-4-sulfonamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CC=C3)C4CCCC4

Isomeric SMILES

CSC1=CC=CC(=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CC=C3)C4CCCC4

InChI

InChI=1S/C21H23N3O2S2/c1-27-19-13-7-10-17(14-19)23-28(25,26)20-15-24(18-11-5-6-12-18)22-21(20)16-8-3-2-4-9-16/h2-4,7-10,13-15,18,23H,5-6,11-12H2,1H3