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

Systemtic Name: N-(1-cyanocycloheptyl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanylacetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]acetamide Formula: C24H27N5OS MolecularWeight: 433.56908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SCC(=O)NC3(CCCCCC3)C#N)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2SCC(=O)NC3(CCCCCC3)C#N)C4=CC=CC=C4)C

InChI

InChI=1S/C24H27N5OS/c1-17-14-18(2)28-29-22(17)21(19-10-6-5-7-11-19)26-23(29)31-15-20(30)27-24(16-25)12-8-3-4-9-13-24/h5-7,10-11,14H,3-4,8-9,12-13,15H2,1-2H3,(H,27,30)