N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-3-cyclohexyl-propanamide

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-3-cyclohexyl-propanamide Openeye Name: 3-cyclohexyl-N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]propionamide Formula: C19H25Cl2N3O3S MolecularWeight: 446.3911

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC(=O)CCC1CCCCC1)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C(=O)NNC(=S)NC(=O)CCC1CCCCC1)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H25Cl2N3O3S/c1-12(27-16-9-8-14(20)11-15(16)21)18(26)23-24-19(28)22-17(25)10-7-13-5-3-2-4-6-13/h8-9,11-13H,2-7,10H2,1H3,(H,23,26)(H2,22,24,25,28)