2-(4-chloranylphenoxy)-N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[5,6-dimethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[5,6-dimethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[5,6-dimethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]acetamide Formula: C20H21ClN2O4S2 MolecularWeight: 452.97474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N(C(=NC(=O)COC3=CC=C(C=C3)Cl)S2)CCSC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N(C(=NC(=O)COC3=CC=C(C=C3)Cl)S2)CCSC)OC

InChI

InChI=1S/C20H21ClN2O4S2/c1-25-16-10-15-18(11-17(16)26-2)29-20(23(15)8-9-28-3)22-19(24)12-27-14-6-4-13(21)5-7-14/h4-7,10-11H,8-9,12H2,1-3H3