3-(2-chlorophenyl)-N-[[2-(2,4-dimethylphenoxy)ethanoylamino]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[2-(2,4-dimethylphenoxy)ethanoylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[2-(2,4-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]thiocarbamoyl]propionamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl)C

InChI

InChI=1S/C20H22ClN3O3S/c1-13-7-9-17(14(2)11-13)27-12-19(26)23-24-20(28)22-18(25)10-8-15-5-3-4-6-16(15)21/h3-7,9,11H,8,10,12H2,1-2H3,(H,23,26)(H2,22,24,25,28)