[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzofuran-2-carboxylate CAS Name: 3-[(4,5-dihydrothiazol-2-ylthio)methyl]-2-benzofurancarboxylic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-[(2-thiazolin-2-ylthio)methyl]coumarilic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H16N2O4S2 MolecularWeight: 388.46064

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NCCS3

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NCCS3

InChI

InChI=1S/C18H16N2O4S2/c1-2-7-19-15(21)10-23-17(22)16-13(11-26-18-20-8-9-25-18)12-5-3-4-6-14(12)24-16/h1,3-6H,7-11H2,(H,19,21)