4-(4-chloranylphenoxy)-N-(hexylcarbamothioyl)butanamide

Systemtic Name: 4-(4-chloranylphenoxy)-N-(hexylcarbamothioyl)butanamide Openeye Name: 4-(4-chlorophenoxy)-N-(hexylcarbamothioyl)butanamide CAS Name: 4-(4-chlorophenoxy)-N-[(hexylamino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(4-chlorophenoxy)-N-(hexylcarbamothioyl)butanamide Traditional Name: 4-(4-chlorophenoxy)-N-(hexylthiocarbamoyl)butyramide Formula: C17H25ClN2O2S MolecularWeight: 356.9106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)NC(=O)CCCOC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCNC(=S)NC(=O)CCCOC1=CC=C(C=C1)Cl

InChI

InChI=1S/C17H25ClN2O2S/c1-2-3-4-5-12-19-17(23)20-16(21)7-6-13-22-15-10-8-14(18)9-11-15/h8-11H,2-7,12-13H2,1H3,(H2,19,20,21,23)