2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-4-mesyl-butyric acid Formula: C10H17N3O6S2 MolecularWeight: 339.38848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C10H17N3O6S2/c1-6-9(7(2)12-11-6)21(18,19)13-8(10(14)15)4-5-20(3,16)17/h8,13H,4-5H2,1-3H3,(H,11,12)(H,14,15)