N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-2-(2-methylphenyl)ethanamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-2-(2-methylphenyl)ethanamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-(o-tolyl)acetamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-(2-methylphenyl)acetamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-2-(o-tolyl)acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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