ethyl 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methoxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methoxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methoxy-benzofuran-3-carboxylate CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-5-methoxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methoxy-1-benzofuran-3-carboxylate Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-5-methoxy-benzofuran-3-carboxylic acid ethyl ester Formula: C20H17NO4S2 MolecularWeight: 399.48328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17NO4S2/c1-3-24-19(22)18-13-10-12(23-2)8-9-15(13)25-16(18)11-26-20-21-14-6-4-5-7-17(14)27-20/h4-10H,3,11H2,1-2H3