2-[4-(4-propylpiperazin-1-yl)sulfonylpyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4-propylpiperazin-1-yl)sulfonylpyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(4-propylpiperazin-1-yl)sulfonylpyrazol-1-yl]acetic acid CAS Name: 2-[4-[(4-propyl-1-piperazinyl)sulfonyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(4-propylpiperazin-1-yl)sulfonylpyrazol-1-yl]acetic acid Traditional Name: 2-[4-(4-propylpiperazino)sulfonylpyrazol-1-yl]acetic acid Formula: C12H20N4O4S MolecularWeight: 316.3766

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)S(=O)(=O)C2=CN(N=C2)CC(=O)O

Isomeric SMILES

CCCN1CCN(CC1)S(=O)(=O)C2=CN(N=C2)CC(=O)O

InChI

InChI=1S/C12H20N4O4S/c1-2-3-14-4-6-16(7-5-14)21(19,20)11-8-13-15(9-11)10-12(17)18/h8-9H,2-7,10H2,1H3,(H,17,18)