ethyl 4-[4-[4-(5-methylpyrazol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[4-(5-methylpyrazol-1-yl)phenyl]carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-[4-(5-methylpyrazol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[[4-(5-methyl-1-pyrazolyl)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(5-methylpyrazol-1-yl)benzoyl]piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[4-(5-methylpyrazol-1-yl)benzoyl]piperazino]sulfonylbenzoic acid ethyl ester Formula: C24H26N4O5S MolecularWeight: 482.55204

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C24H26N4O5S/c1-3-33-24(30)20-6-10-22(11-7-20)34(31,32)27-16-14-26(15-17-27)23(29)19-4-8-21(9-5-19)28-18(2)12-13-25-28/h4-13H,3,14-17H2,1-2H3