2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)-1-thiophen-2-yl-ethanone

Systemtic Name: 2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)-1-thiophen-2-yl-ethanone Openeye Name: 2-[4-(pyridine-4-carbonyl)piperazin-1-yl]-1-(2-thienyl)ethanone CAS Name: 2-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]-1-thiophen-2-ylethanone IUPAC Name: 2-[4-(pyridine-4-carbonyl)piperazin-1-yl]-1-thiophen-2-ylethanone Traditional Name: 2-(4-isonicotinoylpiperazino)-1-(2-thienyl)ethanone Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C16H17N3O2S/c20-14(15-2-1-11-22-15)12-18-7-9-19(10-8-18)16(21)13-3-5-17-6-4-13/h1-6,11H,7-10,12H2