1-(4-nitrophenyl)-2-(6-pyridin-4-ylpyridazin-3-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-nitrophenyl)-2-(6-pyridin-4-ylpyridazin-3-yl)sulfanyl-ethanone Openeye Name: 1-(4-nitrophenyl)-2-[6-(4-pyridyl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(4-nitrophenyl)-2-[(6-pyridin-4-yl-3-pyridazinyl)thio]ethanone IUPAC Name: 1-(4-nitrophenyl)-2-(6-pyridin-4-ylpyridazin-3-yl)sulfanylethanone Traditional Name: 1-(4-nitrophenyl)-2-[[6-(4-pyridyl)pyridazin-3-yl]thio]ethanone Formula: C17H12N4O3S MolecularWeight: 352.36718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=NN=C(C=C2)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=NN=C(C=C2)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O3S/c22-16(13-1-3-14(4-2-13)21(23)24)11-25-17-6-5-15(19-20-17)12-7-9-18-10-8-12/h1-10H,11H2