ethyl 4-[4-(4-pyrazol-1-ylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(4-pyrazol-1-ylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(4-pyrazol-1-ylbenzoyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-pyrazol-1-ylbenzoyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(4-pyrazol-1-ylbenzoyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H24N4O5S/c1-2-32-23(29)19-6-10-21(11-7-19)33(30,31)26-16-14-25(15-17-26)22(28)18-4-8-20(9-5-18)27-13-3-12-24-27/h3-13H,2,14-17H2,1H3