2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[5-(1-piperidylsulfonyl)-2-thienyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(5-piperidinosulfonyl-2-thienyl)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C19H25N5O3S2 MolecularWeight: 435.5635

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H25N5O3S2/c25-17(22-11-13-23(14-12-22)19-20-7-4-8-21-19)15-16-5-6-18(28-16)29(26,27)24-9-2-1-3-10-24/h4-8H,1-3,9-15H2