2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[6-(3-nitrophenyl)-3-pyridazinyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[6-(3-nitrophenyl)pyridazin-3-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[6-(3-nitrophenyl)pyridazin-3-yl]thio]-1-piperidino-ethanone Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3S/c22-17(20-9-2-1-3-10-20)12-25-16-8-7-15(18-19-16)13-5-4-6-14(11-13)21(23)24/h4-8,11H,1-3,9-10,12H2