2-[4-[bis(2-cyanoethyl)sulfamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[bis(2-cyanoethyl)sulfamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[bis(2-cyanoethyl)sulfamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[bis(2-cyanoethyl)sulfamoyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[bis(2-cyanoethyl)sulfamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[bis(2-cyanoethyl)sulfamoyl]pyrazol-1-yl]acetic acid Formula: C11H13N5O4S MolecularWeight: 311.31702

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CC(=O)O)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=C(C=NN1CC(=O)O)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C11H13N5O4S/c12-3-1-5-16(6-2-4-13)21(19,20)10-7-14-15(8-10)9-11(17)18/h7-8H,1-2,5-6,9H2,(H,17,18)