1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfonyl]thiophen-2-yl]ethanone hydrochloride

Systemtic Name: 1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfonyl]thiophen-2-yl]ethanone hydrochloride Openeye Name: 1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfonyl]-2-thienyl]ethanone hydrochloride CAS Name: 1-[5-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propylsulfonyl]-2-thiophenyl]ethanone hydrochloride IUPAC Name: 1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfonyl]thiophen-2-yl]ethanone hydrochloride Traditional Name: 1-[5-[3-[4-(2-pyrimidyl)piperazino]propylsulfonyl]-2-thienyl]ethanone hydrochloride Formula: C17H23ClN4O3S2 MolecularWeight: 430.97252

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)S(=O)(=O)CCCN2CCN(CC2)C3=NC=CC=N3.Cl

Isomeric SMILES

CC(=O)C1=CC=C(S1)S(=O)(=O)CCCN2CCN(CC2)C3=NC=CC=N3.Cl

InChI

InChI=1S/C17H22N4O3S2.ClH/c1-14(22)15-4-5-16(25-15)26(23,24)13-3-8-20-9-11-21(12-10-20)17-18-6-2-7-19-17;/h2,4-7H,3,8-13H2,1H3;1H