1-(2-bromophenyl)sulfonyl-3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-pyrazole

Systemtic Name: 1-(2-bromophenyl)sulfonyl-3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-pyrazole Openeye Name: 1-(2-bromophenyl)sulfonyl-3,5-dimethyl-4-(4-nitrophenyl)sulfanyl-pyrazole CAS Name: 1-(2-bromophenyl)sulfonyl-3,5-dimethyl-4-[(4-nitrophenyl)thio]pyrazole IUPAC Name: 1-(2-bromophenyl)sulfonyl-3,5-dimethyl-4-(4-nitrophenyl)sulfanylpyrazole Traditional Name: 1-(2-bromophenyl)sulfonyl-3,5-dimethyl-4-[(4-nitrophenyl)thio]pyrazole Formula: C17H14BrN3O4S2 MolecularWeight: 468.34476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2Br)C)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2Br)C)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14BrN3O4S2/c1-11-17(26-14-9-7-13(8-10-14)21(22)23)12(2)20(19-11)27(24,25)16-6-4-3-5-15(16)18/h3-10H,1-2H3