[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-ylsulfanyl)propanoate

Systemtic Name: [2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-ylsulfanyl)propanoate Openeye Name: [2-(2-methoxyethylamino)-2-oxo-ethyl] 3-(1,3-benzothiazol-2-ylsulfanyl)propanoate CAS Name: 3-(1,3-benzothiazol-2-ylthio)propanoic acid [2-(2-methoxyethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylamino)-2-oxoethyl] 3-(1,3-benzothiazol-2-ylsulfanyl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-ylthio)propionic acid [2-keto-2-(2-methoxyethylamino)ethyl] ester Formula: C15H18N2O4S2 MolecularWeight: 354.44442

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)COC(=O)CCSC1=NC2=CC=CC=C2S1

Isomeric SMILES

COCCNC(=O)COC(=O)CCSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C15H18N2O4S2/c1-20-8-7-16-13(18)10-21-14(19)6-9-22-15-17-11-4-2-3-5-12(11)23-15/h2-5H,6-10H2,1H3,(H,16,18)