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

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]-3-phenyl-propionamide Formula: C19H19Cl2N3O3S MolecularWeight: 440.34346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC(=O)CCC1=CC=CC=C1)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C(=O)NNC(=S)NC(=O)CCC1=CC=CC=C1)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H19Cl2N3O3S/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/h2-6,8-9,11-12H,7,10H2,1H3,(H,23,26)(H2,22,24,25,28)