4-[2,4-bis(chloranyl)phenoxy]-N-(heptylcarbamothioyl)butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-(heptylcarbamothioyl)butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-(heptylcarbamothioyl)butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[(heptylamino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-(heptylcarbamothioyl)butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-(heptylthiocarbamoyl)butyramide Formula: C18H26Cl2N2O2S MolecularWeight: 405.38224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C18H26Cl2N2O2S/c1-2-3-4-5-6-11-21-18(25)22-17(23)8-7-12-24-16-10-9-14(19)13-15(16)20/h9-10,13H,2-8,11-12H2,1H3,(H2,21,22,23,25)