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

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-2-iodo-benzamide CAS Name: N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-2-iodobenzamide Traditional Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]-2-iodo-benzamide Formula: C18H16Cl2IN3O3S MolecularWeight: 552.21341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16Cl2IN3O3S/c19-11-7-8-15(13(20)10-11)27-9-3-6-16(25)23-24-18(28)22-17(26)12-4-1-2-5-14(12)21/h1-2,4-5,7-8,10H,3,6,9H2,(H,23,25)(H2,22,24,26,28)