(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 4-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 4-(4-thiazolylmethylthio)benzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 4-(thiazol-4-ylmethylthio)benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

Isomeric SMILES

C1COCCN1C(=O)COC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

InChI

InChI=1S/C17H18N2O4S2/c20-16(19-5-7-22-8-6-19)9-23-17(21)13-1-3-15(4-2-13)25-11-14-10-24-12-18-14/h1-4,10,12H,5-9,11H2