1-[4-(4-nitrophenyl)piperazin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(4-pyridylsulfanyl)ethanone CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-2-(pyridin-4-ylthio)ethanone IUPAC Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-pyridin-4-ylsulfanylethanone Traditional Name: 1-[4-(4-nitrophenyl)piperazino]-2-(4-pyridylthio)ethanone Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CSC3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C17H18N4O3S/c22-17(13-25-16-5-7-18-8-6-16)20-11-9-19(10-12-20)14-1-3-15(4-2-14)21(23)24/h1-8H,9-13H2