ethyl 4-[2-[(6-bromanyl-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(6-bromanyl-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(6-bromo-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(6-bromo-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(6-bromo-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(6-bromo-7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C18H17BrN4O3S MolecularWeight: 449.32158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=NC=C(C(=C3N2)C)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=NC=C(C(=C3N2)C)Br

InChI

InChI=1S/C18H17BrN4O3S/c1-3-26-17(25)11-4-6-12(7-5-11)21-14(24)9-27-18-22-15-10(2)13(19)8-20-16(15)23-18/h4-8H,3,9H2,1-2H3,(H,21,24)(H,20,22,23)