N-(3-nitrophenyl)-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide

Systemtic Name: N-(3-nitrophenyl)-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide Openeye Name: N-(3-nitrophenyl)-4-[6-oxo-3-(2-thienyl)pyridazin-1-yl]butanamide CAS Name: N-(3-nitrophenyl)-4-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butanamide IUPAC Name: N-(3-nitrophenyl)-4-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butanamide Traditional Name: 4-[6-keto-3-(2-thienyl)pyridazin-1-yl]-N-(3-nitrophenyl)butyramide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3

InChI

InChI=1S/C18H16N4O4S/c23-17(19-13-4-1-5-14(12-13)22(25)26)7-2-10-21-18(24)9-8-15(20-21)16-6-3-11-27-16/h1,3-6,8-9,11-12H,2,7,10H2,(H,19,23)