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

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]benzamide Formula: C22H25Cl2N3O4S MolecularWeight: 498.4226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O4S/c1-3-4-5-12-30-17-9-6-15(7-10-17)21(29)25-22(32)27-26-20(28)14(2)31-19-11-8-16(23)13-18(19)24/h6-11,13-14H,3-5,12H2,1-2H3,(H,26,28)(H2,25,27,29,32)