4-(5-azanyl-3-methyl-pyrazol-1-yl)-5-methoxy-2-methyl-benzenesulfonic acid

Systemtic Name: 4-(5-azanyl-3-methyl-pyrazol-1-yl)-5-methoxy-2-methyl-benzenesulfonic acid Openeye Name: 4-(5-amino-3-methyl-pyrazol-1-yl)-5-methoxy-2-methyl-benzenesulfonic acid CAS Name: 4-(5-amino-3-methyl-1-pyrazolyl)-5-methoxy-2-methylbenzenesulfonic acid IUPAC Name: 4-(5-amino-3-methylpyrazol-1-yl)-5-methoxy-2-methylbenzenesulfonic acid Traditional Name: 4-(5-amino-3-methyl-pyrazol-1-yl)-5-methoxy-2-methyl-besylic acid Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)O)OC)N2C(=CC(=N2)C)N

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)O)OC)N2C(=CC(=N2)C)N

InChI

InChI=1S/C12H15N3O4S/c1-7-4-9(15-12(13)5-8(2)14-15)10(19-3)6-11(7)20(16,17)18/h4-6H,13H2,1-3H3,(H,16,17,18)