methyl 6-[[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]hexanoate Openeye Name: methyl 6-[[2-(thiazol-4-ylmethylsulfanyl)benzoyl]amino]hexanoate CAS Name: 6-[[oxo-[2-(4-thiazolylmethylthio)phenyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]amino]hexanoate Traditional Name: 6-[[2-(thiazol-4-ylmethylthio)benzoyl]amino]hexanoic acid methyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=CC=CC=C1SCC2=CSC=N2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=CC=CC=C1SCC2=CSC=N2

InChI

InChI=1S/C18H22N2O3S2/c1-23-17(21)9-3-2-6-10-19-18(22)15-7-4-5-8-16(15)25-12-14-11-24-13-20-14/h4-5,7-8,11,13H,2-3,6,9-10,12H2,1H3,(H,19,22)