ethyl 4-[[4-(2-oxidanylpropylsulfanyl)-1,3-benzothiazol-2-yl]oxy]benzoate

Systemtic Name: ethyl 4-[[4-(2-oxidanylpropylsulfanyl)-1,3-benzothiazol-2-yl]oxy]benzoate Openeye Name: ethyl 4-[[4-(2-hydroxypropylsulfanyl)-1,3-benzothiazol-2-yl]oxy]benzoate CAS Name: 4-[[4-(2-hydroxypropylthio)-1,3-benzothiazol-2-yl]oxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(2-hydroxypropylsulfanyl)-1,3-benzothiazol-2-yl]oxy]benzoate Traditional Name: 4-[[4-(2-hydroxypropylthio)-1,3-benzothiazol-2-yl]oxy]benzoic acid ethyl ester Formula: C19H19NO4S2 MolecularWeight: 389.48846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=NC3=C(S2)C=CC=C3SCC(C)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=NC3=C(S2)C=CC=C3SCC(C)O

InChI

InChI=1S/C19H19NO4S2/c1-3-23-18(22)13-7-9-14(10-8-13)24-19-20-17-15(25-11-12(2)21)5-4-6-16(17)26-19/h4-10,12,21H,3,11H2,1-2H3