methyl 4-[[4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzoyl]amino]butanoate CAS Name: 4-[[[4-(2-imidazo[1,2-a]pyridinylmethylthio)phenyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzoyl]amino]butanoate Traditional Name: 4-[[4-(imidazo[1,2-a]pyridin-2-ylmethylthio)benzoyl]amino]butyric acid methyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CC=C(C=C1)SCC2=CN3C=CC=CC3=N2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CC=C(C=C1)SCC2=CN3C=CC=CC3=N2

InChI

InChI=1S/C20H21N3O3S/c1-26-19(24)6-4-11-21-20(25)15-7-9-17(10-8-15)27-14-16-13-23-12-3-2-5-18(23)22-16/h2-3,5,7-10,12-13H,4,6,11,14H2,1H3,(H,21,25)