5-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6,7-dihydro-5H-1-benzothiophen-4-one

Systemtic Name: 5-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6,7-dihydro-5H-1-benzothiophen-4-one Openeye Name: 5-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-6,7-dihydro-5H-benzothiophen-4-one CAS Name: 5-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-6,7-dihydro-5H-1-benzothiophen-4-one IUPAC Name: 5-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6,7-dihydro-5H-1-benzothiophen-4-one Traditional Name: 5-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]-6,7-dihydro-5H-benzothiophen-4-one Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CS2)C(=O)C1CC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CC2=C(C=CS2)C(=O)C1CC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C19H21N3O2S/c23-18(13-14-4-5-16-15(19(14)24)6-12-25-16)22-10-8-21(9-11-22)17-3-1-2-7-20-17/h1-3,6-7,12,14H,4-5,8-11,13H2