methyl 2-[2-(6-methoxycarbonyl-1,3-benzothiazol-2-yl)ethyl]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[2-(6-methoxycarbonyl-1,3-benzothiazol-2-yl)ethyl]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[2-(6-methoxycarbonyl-1,3-benzothiazol-2-yl)ethyl]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[2-(6-methoxycarbonyl-1,3-benzothiazol-2-yl)ethyl]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(6-methoxycarbonyl-1,3-benzothiazol-2-yl)ethyl]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[2-(6-carbomethoxy-1,3-benzothiazol-2-yl)ethyl]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)CCC3=NC4=C(S3)C=C(C=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)CCC3=NC4=C(S3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H16N2O4S2/c1-25-19(23)11-3-5-13-15(9-11)27-17(21-13)7-8-18-22-14-6-4-12(20(24)26-2)10-16(14)28-18/h3-6,9-10H,7-8H2,1-2H3