(4-methylphenyl) 3-(5-azanyl-3-methyl-pyrazol-1-yl)benzenesulfonate

Systemtic Name: (4-methylphenyl) 3-(5-azanyl-3-methyl-pyrazol-1-yl)benzenesulfonate Openeye Name: p-tolyl 3-(5-amino-3-methyl-pyrazol-1-yl)benzenesulfonate CAS Name: 3-(5-amino-3-methyl-1-pyrazolyl)benzenesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3-(5-amino-3-methylpyrazol-1-yl)benzenesulfonate Traditional Name: 3-(5-amino-3-methyl-pyrazol-1-yl)benzenesulfonic acid p-tolyl ester Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)N3C(=CC(=N3)C)N

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)N3C(=CC(=N3)C)N

InChI

InChI=1S/C17H17N3O3S/c1-12-6-8-15(9-7-12)23-24(21,22)16-5-3-4-14(11-16)20-17(18)10-13(2)19-20/h3-11H,18H2,1-2H3