N-(2-cyanophenyl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanophenyl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-acetamide CAS Name: N-(2-cyanophenyl)-2-[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanylacetamide Traditional Name: N-(2-cyanophenyl)-2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]acetamide Formula: C23H19N5OS MolecularWeight: 413.49486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SCC(=O)NC3=CC=CC=C3C#N)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2SCC(=O)NC3=CC=CC=C3C#N)C4=CC=CC=C4)C

InChI

InChI=1S/C23H19N5OS/c1-15-12-16(2)27-28-22(15)21(17-8-4-3-5-9-17)26-23(28)30-14-20(29)25-19-11-7-6-10-18(19)13-24/h3-12H,14H2,1-2H3,(H,25,29)