4-tert-butyl-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[(3-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[(3-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O4S/c1-19(2,3)14-9-7-12(8-10-14)16(24)20-18(28)22-21-17(25)13-5-4-6-15(11-13)23(26)27/h4-11H,1-3H3,(H,21,25)(H2,20,22,24,28)