[4-[3-cyano-5-(4-methylsulfonylphenyl)pyrazol-1-yl]phenyl] methanesulfonate

Systemtic Name: [4-[3-cyano-5-(4-methylsulfonylphenyl)pyrazol-1-yl]phenyl] methanesulfonate Openeye Name: [4-[3-cyano-5-(4-methylsulfonylphenyl)pyrazol-1-yl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-cyano-5-(4-methylsulfonylphenyl)-1-pyrazolyl]phenyl] ester IUPAC Name: [4-[3-cyano-5-(4-methylsulfonylphenyl)pyrazol-1-yl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[3-cyano-5-(4-mesylphenyl)pyrazol-1-yl]phenyl] ester Formula: C18H15N3O5S2 MolecularWeight: 417.4588

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OS(=O)(=O)C)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OS(=O)(=O)C)C#N

InChI

InChI=1S/C18H15N3O5S2/c1-27(22,23)17-9-3-13(4-10-17)18-11-14(12-19)20-21(18)15-5-7-16(8-6-15)26-28(2,24)25/h3-11H,1-2H3