[5-methyl-2-(4-methylphenyl)pyrazol-3-yl] 4-acetamidobenzenesulfonate

Systemtic Name: [5-methyl-2-(4-methylphenyl)pyrazol-3-yl] 4-acetamidobenzenesulfonate Openeye Name: [5-methyl-2-(p-tolyl)pyrazol-3-yl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [5-methyl-2-(4-methylphenyl)-3-pyrazolyl] ester IUPAC Name: [5-methyl-2-(4-methylphenyl)pyrazol-3-yl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [5-methyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)OS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)OS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H19N3O4S/c1-13-4-8-17(9-5-13)22-19(12-14(2)21-22)26-27(24,25)18-10-6-16(7-11-18)20-15(3)23/h4-12H,1-3H3,(H,20,23)