ethyl 5-[5-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-ethenyl]furan-2-yl]-2-chloranyl-benzoate

Systemtic Name: ethyl 5-[5-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-ethenyl]furan-2-yl]-2-chloranyl-benzoate Openeye Name: ethyl 5-[5-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoate CAS Name: 5-[5-[2-(1,3-benzothiazol-2-ylthio)-2-cyanoethenyl]-2-furanyl]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 5-[5-[2-(1,3-benzothiazol-2-ylsulfanyl)-2-cyanoethenyl]furan-2-yl]-2-chlorobenzoate Traditional Name: 5-[5-[2-(1,3-benzothiazol-2-ylthio)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoic acid ethyl ester Formula: C23H15ClN2O3S2 MolecularWeight: 466.9598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C(C#N)SC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C(C#N)SC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C23H15ClN2O3S2/c1-2-28-22(27)17-11-14(7-9-18(17)24)20-10-8-15(29-20)12-16(13-25)30-23-26-19-5-3-4-6-21(19)31-23/h3-12H,2H2,1H3