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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O4S/c1-2-3-12-30-18-8-5-4-7-16(18)21(29)25-22(32)27-26-20(28)9-6-13-31-19-11-10-15(23)14-17(19)24/h4-5,7-8,10-11,14H,2-3,6,9,12-13H2,1H3,(H,26,28)(H2,25,27,29,32)