N-(3-cyanothiophen-2-yl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanylacetamide Traditional Name: N-(3-cyano-2-thienyl)-2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]acetamide Formula: C21H17N5OS2 MolecularWeight: 419.52258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SCC(=O)NC3=C(C=CS3)C#N)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2SCC(=O)NC3=C(C=CS3)C#N)C4=CC=CC=C4)C

InChI

InChI=1S/C21H17N5OS2/c1-13-10-14(2)25-26-19(13)18(15-6-4-3-5-7-15)24-21(26)29-12-17(27)23-20-16(11-22)8-9-28-20/h3-10H,12H2,1-2H3,(H,23,27)