2-(4-tert-butylphenoxy)-N-[[(3-methylphenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[[(3-methylphenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[(3-methylbenzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[[(3-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[(3-methylbenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(m-toluoylamino)thiocarbamoyl]acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H25N3O3S/c1-14-6-5-7-15(12-14)19(26)23-24-20(28)22-18(25)13-27-17-10-8-16(9-11-17)21(2,3)4/h5-12H,13H2,1-4H3,(H,23,26)(H2,22,24,25,28)