ethyl 4-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)sulfonyl]piperazine-1-carboxylate Traditional Name: 4-[(4-carbethoxy-1H-pyrazol-5-yl)sulfonyl]piperazine-1-carboxylic acid ethyl ester Formula: C13H20N4O6S MolecularWeight: 360.3861

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C13H20N4O6S/c1-3-22-12(18)10-9-14-15-11(10)24(20,21)17-7-5-16(6-8-17)13(19)23-4-2/h9H,3-8H2,1-2H3,(H,14,15)