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

Systemtic Name: 2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]ethanamide Openeye Name: 2-(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]acetamide CAS Name: 2-[(2,4-dimethyl-5-phenyl-7-imidazo[1,5-b]pyridazinyl)thio]-N-[(4-sulfamoylphenyl)methyl]acetamide IUPAC Name: 2-(2,4-dimethyl-5-phenylimidazo[1,5-b]pyridazin-7-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]acetamide Traditional Name: 2-[(2,4-dimethyl-5-phenyl-imidazo[1,5-b]pyridazin-7-yl)thio]-N-(4-sulfamoylbenzyl)acetamide Formula: C23H23N5O3S2 MolecularWeight: 481.59042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN2C1=C(N=C2SCC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN2C1=C(N=C2SCC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4)C

InChI

InChI=1S/C23H23N5O3S2/c1-15-12-16(2)27-28-22(15)21(18-6-4-3-5-7-18)26-23(28)32-14-20(29)25-13-17-8-10-19(11-9-17)33(24,30)31/h3-12H,13-14H2,1-2H3,(H,25,29)(H2,24,30,31)