N-[[2-(4-tert-butylphenyl)-6-chloranyl-imidazo[1,2-b]pyridazin-3-yl]methyl]-3-methyl-benzamide

Systemtic Name: N-[[2-(4-tert-butylphenyl)-6-chloranyl-imidazo[1,2-b]pyridazin-3-yl]methyl]-3-methyl-benzamide Openeye Name: N-[[2-(4-tert-butylphenyl)-6-chloro-imidazo[1,2-b]pyridazin-3-yl]methyl]-3-methyl-benzamide CAS Name: N-[[2-(4-tert-butylphenyl)-6-chloro-3-imidazo[1,2-b]pyridazinyl]methyl]-3-methylbenzamide IUPAC Name: N-[[2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazin-3-yl]methyl]-3-methylbenzamide Traditional Name: N-[[2-(4-tert-butylphenyl)-6-chloro-imidazo[1,2-b]pyridazin-3-yl]methyl]-3-methyl-benzamide Formula: C25H25ClN4O MolecularWeight: 432.9452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC2=C(N=C3N2N=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC2=C(N=C3N2N=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H25ClN4O/c1-16-6-5-7-18(14-16)24(31)27-15-20-23(28-22-13-12-21(26)29-30(20)22)17-8-10-19(11-9-17)25(2,3)4/h5-14H,15H2,1-4H3,(H,27,31)