1-[4-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]sulfonyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]sulfonylpiperazino]ethanone Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O3S2/c1-16(25)22-9-11-24(12-10-22)29(26,27)19-15-23(14-17-6-3-2-4-7-17)21-20(19)18-8-5-13-28-18/h2-8,13,15H,9-12,14H2,1H3