ethyl 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-propanoate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-propanoate Openeye Name: ethyl 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-propanoate CAS Name: 2-(1,3-benzothiazol-2-ylthio)-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropanoate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-2-methyl-propionic acid ethyl ester Formula: C13H15NO2S2 MolecularWeight: 281.3937

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)SC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)C(C)(C)SC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H15NO2S2/c1-4-16-11(15)13(2,3)18-12-14-9-7-5-6-8-10(9)17-12/h5-8H,4H2,1-3H3