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

Systemtic Name: N-[[4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]carbamothioyl]benzamide Traditional Name: N-[[4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)phenyl]thiocarbamoyl]benzamide Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(=O)NN=C1C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H16N4O2S/c23-16-11-10-15(21-22-16)12-6-8-14(9-7-12)19-18(25)20-17(24)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,22,23)(H2,19,20,24,25)