methyl 3-[3-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)propanoylamino]benzoate

Systemtic Name: methyl 3-[3-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)propanoylamino]benzoate Openeye Name: methyl 3-[3-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)propanoylamino]benzoate CAS Name: 3-[[3-(2-imidazo[1,2-a]pyridinylmethylthio)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)propanoylamino]benzoate Traditional Name: 3-[3-(imidazo[1,2-a]pyridin-2-ylmethylthio)propanoylamino]benzoic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CCSCC2=CN3C=CC=CC3=N2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CCSCC2=CN3C=CC=CC3=N2

InChI

InChI=1S/C19H19N3O3S/c1-25-19(24)14-5-4-6-15(11-14)21-18(23)8-10-26-13-16-12-22-9-3-2-7-17(22)20-16/h2-7,9,11-12H,8,10,13H2,1H3,(H,21,23)