(5-azanyl-1-methylsulfonyl-pyrazol-3-yl) 4-chloranylbenzoate

Systemtic Name: (5-azanyl-1-methylsulfonyl-pyrazol-3-yl) 4-chloranylbenzoate Openeye Name: (5-amino-1-methylsulfonyl-pyrazol-3-yl) 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid (5-amino-1-methylsulfonyl-3-pyrazolyl) ester IUPAC Name: (5-amino-1-methylsulfonylpyrazol-3-yl) 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid (5-amino-1-mesyl-pyrazol-3-yl) ester Formula: C11H10ClN3O4S MolecularWeight: 315.7328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(=CC(=N1)OC(=O)C2=CC=C(C=C2)Cl)N

Isomeric SMILES

CS(=O)(=O)N1C(=CC(=N1)OC(=O)C2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C11H10ClN3O4S/c1-20(17,18)15-9(13)6-10(14-15)19-11(16)7-2-4-8(12)5-3-7/h2-6H,13H2,1H3