N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]-2-hexoxy-benzamide Formula: C23H27Cl2N3O4S MolecularWeight: 512.44918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C23H27Cl2N3O4S/c1-3-4-5-8-13-31-19-10-7-6-9-17(19)22(30)26-23(33)28-27-21(29)15(2)32-20-12-11-16(24)14-18(20)25/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3,(H,27,29)(H2,26,28,30,33)