methyl 2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-ethenyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-ethenyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-vinyl]phenoxy]acetate CAS Name: 2-[4-[2-(1,3-benzothiazol-2-ylthio)-2-cyanoethenyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyanoethenyl]phenoxy]acetate Traditional Name: 2-[4-[2-(1,3-benzothiazol-2-ylthio)-2-cyano-vinyl]phenoxy]acetic acid methyl ester Formula: C19H14N2O3S2 MolecularWeight: 382.45606

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H14N2O3S2/c1-23-18(22)12-24-14-8-6-13(7-9-14)10-15(11-20)25-19-21-16-4-2-3-5-17(16)26-19/h2-10H,12H2,1H3