propan-2-yl 4-[2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-(1H-imidazo[4,5-b]pyridin-2-ylthio)-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1H-imidazo[4,5-b]pyridin-2-ylthio)acetyl]amino]benzoic acid isopropyl ester Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C=CC=N3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C=CC=N3

InChI

InChI=1S/C18H18N4O3S/c1-11(2)25-17(24)12-5-7-13(8-6-12)20-15(23)10-26-18-21-14-4-3-9-19-16(14)22-18/h3-9,11H,10H2,1-2H3,(H,20,23)(H,19,21,22)