1-benzothiophen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: 1-benzothiophen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: benzothiophen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: 1-benzothiophen-3-yl-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: 1-benzothiophen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: benzothiophen-3-yl-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C17H16N4OS/c22-16(14-12-23-15-5-2-1-4-13(14)15)20-8-10-21(11-9-20)17-18-6-3-7-19-17/h1-7,12H,8-11H2