N-[2-methoxy-5-(trifluoromethyl)phenyl]-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide

Systemtic Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide Openeye Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-4-[6-oxo-3-(2-thienyl)pyridazin-1-yl]butanamide CAS Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-4-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butanamide IUPAC Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-4-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butanamide Traditional Name: 4-[6-keto-3-(2-thienyl)pyridazin-1-yl]-N-[2-methoxy-5-(trifluoromethyl)phenyl]butyramide Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3

InChI

InChI=1S/C20H18F3N3O3S/c1-29-16-8-6-13(20(21,22)23)12-15(16)24-18(27)5-2-10-26-19(28)9-7-14(25-26)17-4-3-11-30-17/h3-4,6-9,11-12H,2,5,10H2,1H3,(H,24,27)