3-[5-(1,3-benzothiazol-2-ylmethoxy)-2-chloranyl-phenoxy]-5-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[5-(1,3-benzothiazol-2-ylmethoxy)-2-chloranyl-phenoxy]-5-chloranyl-benzenecarbonitrile Openeye Name: 3-[5-(1,3-benzothiazol-2-ylmethoxy)-2-chloro-phenoxy]-5-chloro-benzonitrile CAS Name: 3-[5-(1,3-benzothiazol-2-ylmethoxy)-2-chlorophenoxy]-5-chlorobenzonitrile IUPAC Name: 3-[5-(1,3-benzothiazol-2-ylmethoxy)-2-chlorophenoxy]-5-chlorobenzonitrile Traditional Name: 3-[5-(1,3-benzothiazol-2-ylmethoxy)-2-chloro-phenoxy]-5-chloro-benzonitrile Formula: C21H12Cl2N2O2S MolecularWeight: 427.30318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC3=CC(=C(C=C3)Cl)OC4=CC(=CC(=C4)C#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC3=CC(=C(C=C3)Cl)OC4=CC(=CC(=C4)C#N)Cl

InChI

InChI=1S/C21H12Cl2N2O2S/c22-14-7-13(11-24)8-16(9-14)27-19-10-15(5-6-17(19)23)26-12-21-25-18-3-1-2-4-20(18)28-21/h1-10H,12H2