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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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