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

Systemtic Name: 1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfanyl]thiophen-2-yl]ethanone Openeye Name: 1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfanyl]-2-thienyl]ethanone CAS Name: 1-[5-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propylthio]-2-thiophenyl]ethanone IUPAC Name: 1-[5-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfanyl]thiophen-2-yl]ethanone Traditional Name: 1-[5-[3-[4-(2-pyrimidyl)piperazino]propylthio]-2-thienyl]ethanone Formula: C17H22N4OS2 MolecularWeight: 362.51278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)SCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(=O)C1=CC=C(S1)SCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H22N4OS2/c1-14(22)15-4-5-16(24-15)23-13-3-8-20-9-11-21(12-10-20)17-18-6-2-7-19-17/h2,4-7H,3,8-13H2,1H3