1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-(1-phenylpyrazol-4-yl)ethanone

Systemtic Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-(1-phenylpyrazol-4-yl)ethanone Openeye Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-(1-phenylpyrazol-4-yl)ethanone CAS Name: 1-[4-(3,4-diethoxyphenyl)sulfonyl-1-piperazinyl]-2-(1-phenyl-4-pyrazolyl)ethanone IUPAC Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-(1-phenylpyrazol-4-yl)ethanone Traditional Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazino]-2-(1-phenylpyrazol-4-yl)ethanone Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CN(N=C3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CN(N=C3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C25H30N4O5S/c1-3-33-23-11-10-22(17-24(23)34-4-2)35(31,32)28-14-12-27(13-15-28)25(30)16-20-18-26-29(19-20)21-8-6-5-7-9-21/h5-11,17-19H,3-4,12-16H2,1-2H3