5-bromanyl-2-(2-methylpropoxy)-N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-(2-methylpropoxy)-N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 5-bromo-2-isobutoxy-N-[[(2-nitrobenzoyl)amino]carbamothioyl]benzamide CAS Name: 5-bromo-2-(2-methylpropoxy)-N-[[[(2-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-(2-methylpropoxy)-N-[[(2-nitrobenzoyl)amino]carbamothioyl]benzamide Traditional Name: 5-bromo-2-isobutoxy-N-[[(2-nitrobenzoyl)amino]thiocarbamoyl]benzamide Formula: C19H19BrN4O5S MolecularWeight: 495.34696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H19BrN4O5S/c1-11(2)10-29-16-8-7-12(20)9-14(16)17(25)21-19(30)23-22-18(26)13-5-3-4-6-15(13)24(27)28/h3-9,11H,10H2,1-2H3,(H,22,26)(H2,21,23,25,30)