4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-[6-oxo-3-(2-thienyl)pyridazin-1-yl]-N-[3-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)-N-[3-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)-N-[3-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-[6-keto-3-(2-thienyl)pyridazin-1-yl]-N-[3-(trifluoromethyl)phenyl]butyramide Formula: C19H16F3N3O2S MolecularWeight: 407.40945

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O2S/c20-19(21,22)13-4-1-5-14(12-13)23-17(26)7-2-10-25-18(27)9-8-15(24-25)16-6-3-11-28-16/h1,3-6,8-9,11-12H,2,7,10H2,(H,23,26)