ethyl 2-[(6-cyano-1,3-benzothiazol-2-yl)sulfanyl]-2-methyl-propanoate

Systemtic Name: ethyl 2-[(6-cyano-1,3-benzothiazol-2-yl)sulfanyl]-2-methyl-propanoate Openeye Name: ethyl 2-[(6-cyano-1,3-benzothiazol-2-yl)sulfanyl]-2-methyl-propanoate CAS Name: 2-[(6-cyano-1,3-benzothiazol-2-yl)thio]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[(6-cyano-1,3-benzothiazol-2-yl)sulfanyl]-2-methylpropanoate Traditional Name: 2-[(6-cyano-1,3-benzothiazol-2-yl)thio]-2-methyl-propionic acid ethyl ester Formula: C14H14N2O2S2 MolecularWeight: 306.40316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)SC1=NC2=C(S1)C=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C(C)(C)SC1=NC2=C(S1)C=C(C=C2)C#N

InChI

InChI=1S/C14H14N2O2S2/c1-4-18-12(17)14(2,3)20-13-16-10-6-5-9(8-15)7-11(10)19-13/h5-7H,4H2,1-3H3