N-[[2-(4-cyclohexylphenyl)-6-methylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide

Systemtic Name: N-[[2-(4-cyclohexylphenyl)-6-methylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Openeye Name: N-[[2-(4-cyclohexylphenyl)-6-methylsulfanyl-imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide CAS Name: N-[[2-(4-cyclohexylphenyl)-6-(methylthio)-3-imidazo[1,2-b]pyridazinyl]methyl]benzamide IUPAC Name: N-[[2-(4-cyclohexylphenyl)-6-methylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Traditional Name: N-[[2-(4-cyclohexylphenyl)-6-(methylthio)imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN2C(=NC(=C2CNC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C5CCCCC5)C=C1

Isomeric SMILES

CSC1=NN2C(=NC(=C2CNC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C5CCCCC5)C=C1

InChI

InChI=1S/C27H28N4OS/c1-33-25-17-16-24-29-26(21-14-12-20(13-15-21)19-8-4-2-5-9-19)23(31(24)30-25)18-28-27(32)22-10-6-3-7-11-22/h3,6-7,10-17,19H,2,4-5,8-9,18H2,1H3,(H,28,32)