2,6-bis(bromanyl)-4-[(2-nitrophenyl)carbonylcarbamothioylamino]phenolate

Systemtic Name: 2,6-bis(bromanyl)-4-[(2-nitrophenyl)carbonylcarbamothioylamino]phenolate Openeye Name: 2,6-dibromo-4-[(2-nitrobenzoyl)carbamothioylamino]phenolate CAS Name: 2,6-dibromo-4-[[[[(2-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dibromo-4-[(2-nitrobenzoyl)carbamothioylamino]phenolate Traditional Name: 2,6-dibromo-4-[(2-nitrobenzoyl)thiocarbamoylamino]phenolate Formula: C14H8Br2N3O4S- MolecularWeight: 474.10402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C14H9Br2N3O4S/c15-9-5-7(6-10(16)12(9)20)17-14(24)18-13(21)8-3-1-2-4-11(8)19(22)23/h1-6,20H,(H2,17,18,21,24)/p-1