3-bromanyl-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[(3-nitrobenzoyl)amino]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[(3-nitrobenzoyl)amino]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]-4-propoxy-benzamide Formula: C18H17BrN4O5S MolecularWeight: 481.32038

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C18H17BrN4O5S/c1-2-8-28-15-7-6-12(10-14(15)19)16(24)20-18(29)22-21-17(25)11-4-3-5-13(9-11)23(26)27/h3-7,9-10H,2,8H2,1H3,(H,21,25)(H2,20,22,24,29)