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

Systemtic Name: 3-(5-azanyl-3-methyl-pyrazol-1-yl)-4-chloranyl-benzenesulfonic acid Openeye Name: 3-(5-amino-3-methyl-pyrazol-1-yl)-4-chloro-benzenesulfonic acid CAS Name: 3-(5-amino-3-methyl-1-pyrazolyl)-4-chlorobenzenesulfonic acid IUPAC Name: 3-(5-amino-3-methylpyrazol-1-yl)-4-chlorobenzenesulfonic acid Traditional Name: 3-(5-amino-3-methyl-pyrazol-1-yl)-4-chloro-besylic acid Formula: C10H10ClN3O3S MolecularWeight: 287.7227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)N)C2=C(C=CC(=C2)S(=O)(=O)O)Cl

Isomeric SMILES

CC1=NN(C(=C1)N)C2=C(C=CC(=C2)S(=O)(=O)O)Cl

InChI

InChI=1S/C10H10ClN3O3S/c1-6-4-10(12)14(13-6)9-5-7(18(15,16)17)2-3-8(9)11/h2-5H,12H2,1H3,(H,15,16,17)