ethyl 2-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethyl 2-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 2-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-hydroxy-propoxy]benzoate CAS Name: 2-[3-(1,3-benzothiazol-2-ylthio)-2-hydroxypropoxy]benzoic acid ethyl ester IUPAC Name: ethyl 2-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-hydroxypropoxy]benzoate Traditional Name: 2-[3-(1,3-benzothiazol-2-ylthio)-2-hydroxy-propoxy]benzoic acid ethyl ester Formula: C19H19NO4S2 MolecularWeight: 389.48846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1OCC(CSC2=NC3=CC=CC=C3S2)O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1OCC(CSC2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C19H19NO4S2/c1-2-23-18(22)14-7-3-5-9-16(14)24-11-13(21)12-25-19-20-15-8-4-6-10-17(15)26-19/h3-10,13,21H,2,11-12H2,1H3