ethyl (2E)-2-cyano-2-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]ethanoate

Systemtic Name: ethyl (2E)-2-cyano-2-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]ethanoate Openeye Name: ethyl (2E)-2-cyano-2-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]acetate CAS Name: (2E)-2-cyano-2-[3-(2-mercaptoethyl)-1,3-benzothiazol-2-ylidene]acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-cyano-2-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]acetate Traditional Name: (2E)-2-cyano-2-[3-(2-mercaptoethyl)-1,3-benzothiazol-2-ylidene]acetic acid ethyl ester Formula: C14H14N2O2S2 MolecularWeight: 306.40316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1N(C2=CC=CC=C2S1)CCS)C#N

Isomeric SMILES

CCOC(=O)/C(=C/1\N(C2=CC=CC=C2S1)CCS)/C#N

InChI

InChI=1S/C14H14N2O2S2/c1-2-18-14(17)10(9-15)13-16(7-8-19)11-5-3-4-6-12(11)20-13/h3-6,19H,2,7-8H2,1H3/b13-10+