2-(4-chloranylphenoxy)-N-(heptylcarbamothioyl)ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-(heptylcarbamothioyl)ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-(heptylcarbamothioyl)acetamide CAS Name: 2-(4-chlorophenoxy)-N-[(heptylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-(heptylcarbamothioyl)acetamide Traditional Name: 2-(4-chlorophenoxy)-N-(heptylthiocarbamoyl)acetamide Formula: C16H23ClN2O2S MolecularWeight: 342.88402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)COC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)COC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H23ClN2O2S/c1-2-3-4-5-6-11-18-16(22)19-15(20)12-21-14-9-7-13(17)8-10-14/h7-10H,2-6,11-12H2,1H3,(H2,18,19,20,22)