2,2-dimethyl-N-[3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]phenyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]phenyl]propanamide Openeye Name: 2,2-dimethyl-N-[3-[[2-(o-tolyl)acetyl]carbamothioylamino]phenyl]propanamide CAS Name: 2,2-dimethyl-N-[3-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: 2,2-dimethyl-N-[3-[[2-(2-methylphenyl)acetyl]carbamothioylamino]phenyl]propanamide Traditional Name: 2,2-dimethyl-N-[3-[[2-(o-tolyl)acetyl]thiocarbamoylamino]phenyl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)(C)C

InChI

InChI=1S/C21H25N3O2S/c1-14-8-5-6-9-15(14)12-18(25)24-20(27)23-17-11-7-10-16(13-17)22-19(26)21(2,3)4/h5-11,13H,12H2,1-4H3,(H,22,26)(H2,23,24,25,27)