N-[[(4-chlorophenyl)carbonylamino]carbamothioyl]-2-(3,5-dimethylphenoxy)ethanamide

Systemtic Name: N-[[(4-chlorophenyl)carbonylamino]carbamothioyl]-2-(3,5-dimethylphenoxy)ethanamide Openeye Name: N-[[(4-chlorobenzoyl)amino]carbamothioyl]-2-(3,5-dimethylphenoxy)acetamide CAS Name: N-[[[(4-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(3,5-dimethylphenoxy)acetamide IUPAC Name: N-[[(4-chlorobenzoyl)amino]carbamothioyl]-2-(3,5-dimethylphenoxy)acetamide Traditional Name: N-[[(4-chlorobenzoyl)amino]thiocarbamoyl]-2-(3,5-dimethylphenoxy)acetamide Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C18H18ClN3O3S/c1-11-7-12(2)9-15(8-11)25-10-16(23)20-18(26)22-21-17(24)13-3-5-14(19)6-4-13/h3-9H,10H2,1-2H3,(H,21,24)(H2,20,22,23,26)