[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(4,5-dihydrothiazol-2-ylthio)methyl]-2-benzofurancarboxylic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(2-thiazolin-2-ylthio)methyl]coumarilic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NCCS3

Isomeric SMILES

C[C@H](C(=O)NCC=C)OC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NCCS3

InChI

InChI=1S/C19H20N2O4S2/c1-3-8-20-17(22)12(2)24-18(23)16-14(11-27-19-21-9-10-26-19)13-6-4-5-7-15(13)25-16/h3-7,12H,1,8-11H2,2H3,(H,20,22)/t12-/m1/s1