N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-4-butan-2-yloxy-benzamide

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-4-butan-2-yloxy-benzamide Openeye Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-sec-butoxy-benzamide CAS Name: 4-butan-2-yloxy-N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butan-2-yloxy-N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]benzamide Traditional Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]-4-sec-butoxy-benzamide Formula: C22H25Cl2N3O4S MolecularWeight: 498.4226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

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