5-[ethyl(phenylsulfonyl)amino]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[ethyl(phenylsulfonyl)amino]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[benzenesulfonyl(ethyl)amino]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[benzenesulfonyl(ethyl)amino]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[benzenesulfonyl(ethyl)amino]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[besyl(ethyl)amino]-1-methyl-pyrazole-4-carboxylic acid Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=NN1C)C(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCN(C1=C(C=NN1C)C(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3O4S/c1-3-16(12-11(13(17)18)9-14-15(12)2)21(19,20)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,17,18)