2-(3,4-dimethylphenoxy)-N-[2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: 2-(3,4-dimethylphenoxy)-N-[2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[2-(2-anilino-2-oxo-ethyl)sulfanyl-1,3-benzothiazol-6-yl]-2-(3,4-dimethylphenoxy)acetamide CAS Name: N-[2-[(2-anilino-2-oxoethyl)thio]-1,3-benzothiazol-6-yl]-2-(3,4-dimethylphenoxy)acetamide IUPAC Name: N-[2-(2-anilino-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]-2-(3,4-dimethylphenoxy)acetamide Traditional Name: N-[2-[(2-anilino-2-keto-ethyl)thio]-1,3-benzothiazol-6-yl]-2-(3,4-dimethylphenoxy)acetamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O3S2/c1-16-8-10-20(12-17(16)2)31-14-23(29)27-19-9-11-21-22(13-19)33-25(28-21)32-15-24(30)26-18-6-4-3-5-7-18/h3-13H,14-15H2,1-2H3,(H,26,30)(H,27,29)