N-[[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]carbamothioyl]octanamide

Systemtic Name: N-[[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]carbamothioyl]octanamide Openeye Name: N-[[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]carbamothioyl]octanamide CAS Name: N-[[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]carbamothioyl]octanamide Traditional Name: N-[[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]thiocarbamoyl]caprylamide Formula: C19H28ClN3O3S MolecularWeight: 413.96192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NNC(=O)COC1=CC(=C(C(=C1)C)Cl)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NNC(=O)COC1=CC(=C(C(=C1)C)Cl)C

InChI

InChI=1S/C19H28ClN3O3S/c1-4-5-6-7-8-9-16(24)21-19(27)23-22-17(25)12-26-15-10-13(2)18(20)14(3)11-15/h10-11H,4-9,12H2,1-3H3,(H,22,25)(H2,21,23,24,27)