4-methylsulfanyl-N-[2-nitro-4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzamide

Systemtic Name: 4-methylsulfanyl-N-[2-nitro-4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzamide Openeye Name: 4-methylsulfanyl-N-[2-nitro-4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzamide CAS Name: 4-(methylthio)-N-[2-nitro-4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzamide IUPAC Name: 4-methylsulfanyl-N-[2-nitro-4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]benzamide Traditional Name: N-[4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]-4-(methylthio)benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)C3=NNC(=O)CC3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)C3=NNC(=O)CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c1-27-13-5-2-11(3-6-13)18(24)19-15-7-4-12(10-16(15)22(25)26)14-8-9-17(23)21-20-14/h2-7,10H,8-9H2,1H3,(H,19,24)(H,21,23)