3-[4-[2-cyanoethyl(propan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-cyanoethyl(propan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[2-cyanoethyl(isopropyl)sulfamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[2-cyanoethyl(propan-2-yl)sulfamoyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[2-cyanoethyl(propan-2-yl)sulfamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[2-cyanoethyl(isopropyl)sulfamoyl]pyrazol-1-yl]propionic acid Formula: C12H18N4O4S MolecularWeight: 314.36072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC#N)S(=O)(=O)C1=CN(N=C1)CCC(=O)O

Isomeric SMILES

CC(C)N(CCC#N)S(=O)(=O)C1=CN(N=C1)CCC(=O)O

InChI

InChI=1S/C12H18N4O4S/c1-10(2)16(6-3-5-13)21(19,20)11-8-14-15(9-11)7-4-12(17)18/h8-10H,3-4,6-7H2,1-2H3,(H,17,18)