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

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]-2-hexoxy-benzamide Formula: C24H29Cl2N3O4S MolecularWeight: 526.47576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C24H29Cl2N3O4S/c1-2-3-4-7-14-32-20-10-6-5-9-18(20)23(31)27-24(34)29-28-22(30)11-8-15-33-21-13-12-17(25)16-19(21)26/h5-6,9-10,12-13,16H,2-4,7-8,11,14-15H2,1H3,(H,28,30)(H2,27,29,31,34)