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

Systemtic Name: 2,3-dihydro-1-benzothiophen-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: 2,3-dihydrobenzothiophen-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: 2,3-dihydro-1-benzothiophen-2-yl-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1-benzothiophen-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: 2,3-dihydrobenzothiophen-2-yl-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3CC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3CC4=CC=CC=C4S3

InChI

InChI=1S/C17H18N4OS/c22-16(15-12-13-4-1-2-5-14(13)23-15)20-8-10-21(11-9-20)17-18-6-3-7-19-17/h1-7,15H,8-12H2