methyl 2-[(7-methoxy-1-benzofuran-2-yl)carbonylimino]-3-(2-methylsulfanylethyl)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(7-methoxy-1-benzofuran-2-yl)carbonylimino]-3-(2-methylsulfanylethyl)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(7-methoxybenzofuran-2-carbonyl)imino-3-(2-methylsulfanylethyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(7-methoxy-2-benzofuranyl)-oxomethyl]imino-3-[2-(methylthio)ethyl]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(7-methoxy-1-benzofuran-2-carbonyl)imino-3-(2-methylsulfanylethyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(7-methoxybenzofuran-2-carbonyl)imino-3-[2-(methylthio)ethyl]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)C(=O)OC)CCSC

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)C(=O)OC)CCSC

InChI

InChI=1S/C22H20N2O5S2/c1-27-16-6-4-5-13-11-17(29-19(13)16)20(25)23-22-24(9-10-30-3)15-8-7-14(21(26)28-2)12-18(15)31-22/h4-8,11-12H,9-10H2,1-3H3