N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[3-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[3-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]-2,2-dimethyl-propionamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C21H24ClN3O2S/c1-21(2,3)19(27)23-15-8-6-9-16(13-15)24-20(28)25-18(26)12-11-14-7-4-5-10-17(14)22/h4-10,13H,11-12H2,1-3H3,(H,23,27)(H2,24,25,26,28)