1-[(6-bromanyl-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[(6-bromanyl-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 1-[(6-bromo-5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)thio]-3,3-dimethyl-butan-2-one Formula: C13H16BrN3OS MolecularWeight: 342.25464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=N1)N=C(N2)SCC(=O)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=C2C(=N1)N=C(N2)SCC(=O)C(C)(C)C)Br

InChI

InChI=1S/C13H16BrN3OS/c1-7-8(14)5-9-11(15-7)17-12(16-9)19-6-10(18)13(2,3)4/h5H,6H2,1-4H3,(H,15,16,17)