1-(4-chlorophenyl)sulfonyl-3-(2-methylsulfanyl-5-nitro-phenyl)pyrazole

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-3-(2-methylsulfanyl-5-nitro-phenyl)pyrazole Openeye Name: 1-(4-chlorophenyl)sulfonyl-3-(2-methylsulfanyl-5-nitro-phenyl)pyrazole CAS Name: 1-(4-chlorophenyl)sulfonyl-3-[2-(methylthio)-5-nitrophenyl]pyrazole IUPAC Name: 1-(4-chlorophenyl)sulfonyl-3-(2-methylsulfanyl-5-nitrophenyl)pyrazole Traditional Name: 1-(4-chlorophenyl)sulfonyl-3-[2-(methylthio)-5-nitro-phenyl]pyrazole Formula: C16H12ClN3O4S2 MolecularWeight: 409.86718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)[N+](=O)[O-])C2=NN(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)[N+](=O)[O-])C2=NN(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3O4S2/c1-25-16-7-4-12(20(21)22)10-14(16)15-8-9-19(18-15)26(23,24)13-5-2-11(17)3-6-13/h2-10H,1H3