4-(3-chloranyl-4-methylsulfanyl-phenyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide

Systemtic Name: 4-(3-chloranyl-4-methylsulfanyl-phenyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Openeye Name: 4-(3-chloro-4-methylsulfanyl-phenyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide CAS Name: 4-[3-chloro-4-(methylthio)phenyl]-2-(1H-pyrazol-5-yl)benzenesulfonamide IUPAC Name: 4-(3-chloro-4-methylsulfanylphenyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Traditional Name: 4-[3-chloro-4-(methylthio)phenyl]-2-(1H-pyrazol-5-yl)benzenesulfonamide Formula: C16H14ClN3O2S2 MolecularWeight: 379.88426

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C2=CC(=C(C=C2)S(=O)(=O)N)C3=CC=NN3)Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)C2=CC(=C(C=C2)S(=O)(=O)N)C3=CC=NN3)Cl

InChI

InChI=1S/C16H14ClN3O2S2/c1-23-15-4-2-11(9-13(15)17)10-3-5-16(24(18,21)22)12(8-10)14-6-7-19-20-14/h2-9H,1H3,(H,19,20)(H2,18,21,22)