3-[3,5-dimethyl-4-(pentylsulfamoyl)pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[3,5-dimethyl-4-(pentylsulfamoyl)pyrazol-1-yl]propanoic acid Openeye Name: 3-[3,5-dimethyl-4-(pentylsulfamoyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[3,5-dimethyl-4-(pentylsulfamoyl)-1-pyrazolyl]propanoic acid IUPAC Name: 3-[3,5-dimethyl-4-(pentylsulfamoyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(amylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C13H23N3O4S MolecularWeight: 317.40442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNS(=O)(=O)C1=C(N(N=C1C)CCC(=O)O)C

Isomeric SMILES

CCCCCNS(=O)(=O)C1=C(N(N=C1C)CCC(=O)O)C

InChI

InChI=1S/C13H23N3O4S/c1-4-5-6-8-14-21(19,20)13-10(2)15-16(11(13)3)9-7-12(17)18/h14H,4-9H2,1-3H3,(H,17,18)