ethyl 5-azanyl-3-[(4-methylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[(4-methylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-(p-tolylsulfonylamino)-1H-pyrazole-4-carboxylate CAS Name: 5-amino-3-[(4-methylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(4-methylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-amino-3-(tosylamino)-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C13H16N4O4S MolecularWeight: 324.35554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1NS(=O)(=O)C2=CC=C(C=C2)C)N

Isomeric SMILES

CCOC(=O)C1=C(NN=C1NS(=O)(=O)C2=CC=C(C=C2)C)N

InChI

InChI=1S/C13H16N4O4S/c1-3-21-13(18)10-11(14)15-16-12(10)17-22(19,20)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H4,14,15,16,17)