2-[4-chloranyl-2-(3-cyanophenyl)carbonyl-phenoxy]-N-(2-methyl-1,3-benzothiazol-5-yl)ethanamide

Systemtic Name: 2-[4-chloranyl-2-(3-cyanophenyl)carbonyl-phenoxy]-N-(2-methyl-1,3-benzothiazol-5-yl)ethanamide Openeye Name: 2-[4-chloro-2-(3-cyanobenzoyl)phenoxy]-N-(2-methyl-1,3-benzothiazol-5-yl)acetamide CAS Name: 2-[4-chloro-2-[(3-cyanophenyl)-oxomethyl]phenoxy]-N-(2-methyl-1,3-benzothiazol-5-yl)acetamide IUPAC Name: 2-[4-chloro-2-(3-cyanobenzoyl)phenoxy]-N-(2-methyl-1,3-benzothiazol-5-yl)acetamide Traditional Name: 2-[4-chloro-2-(3-cyanobenzoyl)phenoxy]-N-(2-methyl-1,3-benzothiazol-5-yl)acetamide Formula: C24H16ClN3O3S MolecularWeight: 461.92014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)NC(=O)COC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)NC(=O)COC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H16ClN3O3S/c1-14-27-20-11-18(6-8-22(20)32-14)28-23(29)13-31-21-7-5-17(25)10-19(21)24(30)16-4-2-3-15(9-16)12-26/h2-11H,13H2,1H3,(H,28,29)