N-(4-bromanyl-3,5-dimethyl-phenyl)-2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-3,5-dimethyl-phenyl)-2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethanamide Openeye Name: N-(4-bromo-3,5-dimethyl-phenyl)-2-[6-oxo-3-(2-thienyl)pyridazin-1-yl]acetamide CAS Name: N-(4-bromo-3,5-dimethylphenyl)-2-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)acetamide IUPAC Name: N-(4-bromo-3,5-dimethylphenyl)-2-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)acetamide Traditional Name: N-(4-bromo-3,5-dimethyl-phenyl)-2-[6-keto-3-(2-thienyl)pyridazin-1-yl]acetamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)NC(=O)CN2C(=O)C=CC(=N2)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)NC(=O)CN2C(=O)C=CC(=N2)C3=CC=CS3

InChI

InChI=1S/C18H16BrN3O2S/c1-11-8-13(9-12(2)18(11)19)20-16(23)10-22-17(24)6-5-14(21-22)15-4-3-7-25-15/h3-9H,10H2,1-2H3,(H,20,23)