2-[2,4-bis(chloranyl)phenoxy]-N-(2-hexylsulfanyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-(2-hexylsulfanyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-(2-hexylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-(2,4-dichlorophenoxy)-N-[2-(hexylthio)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(2,4-dichlorophenoxy)-N-(2-hexylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[2-(hexylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C21H22Cl2N2O2S2 MolecularWeight: 469.44758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H22Cl2N2O2S2/c1-2-3-4-5-10-28-21-25-17-8-7-15(12-19(17)29-21)24-20(26)13-27-18-9-6-14(22)11-16(18)23/h6-9,11-12H,2-5,10,13H2,1H3,(H,24,26)