[4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] methanesulfonate

Systemtic Name: [4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] methanesulfonate Openeye Name: [4-(2-nitrophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] methanesulfonate CAS Name: methanesulfonic acid [4-[(2-nitrophenyl)thio]-2-phenyl-3-pyrazolyl] ester IUPAC Name: [4-(2-nitrophenyl)sulfanyl-2-phenylpyrazol-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(2-nitrophenyl)thio]-2-phenyl-pyrazol-3-yl] ester Formula: C16H13N3O5S2 MolecularWeight: 391.42152

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=C(C=NN1C2=CC=CC=C2)SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1=C(C=NN1C2=CC=CC=C2)SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O5S2/c1-26(22,23)24-16-15(11-17-18(16)12-7-3-2-4-8-12)25-14-10-6-5-9-13(14)19(20)21/h2-11H,1H3