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

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[(4-nitrobenzoyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[(4-nitrobenzoyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[[(4-nitrobenzoyl)amino]thiocarbamoyl]acetamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5S/c1-20(2,3)14-6-10-16(11-7-14)29-12-17(25)21-19(30)23-22-18(26)13-4-8-15(9-5-13)24(27)28/h4-11H,12H2,1-3H3,(H,22,26)(H2,21,23,25,30)