2,6-bis(bromanyl)-4-(2-phenylethanoylcarbamothioylamino)phenolate

Systemtic Name: 2,6-bis(bromanyl)-4-(2-phenylethanoylcarbamothioylamino)phenolate Openeye Name: 2,6-dibromo-4-[(2-phenylacetyl)carbamothioylamino]phenolate CAS Name: 2,6-dibromo-4-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dibromo-4-[(2-phenylacetyl)carbamothioylamino]phenolate Traditional Name: 2,6-dibromo-4-[(2-phenylacetyl)thiocarbamoylamino]phenolate Formula: C15H11Br2N2O2S- MolecularWeight: 443.13304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12Br2N2O2S/c16-11-7-10(8-12(17)14(11)21)18-15(22)19-13(20)6-9-4-2-1-3-5-9/h1-5,7-8,21H,6H2,(H2,18,19,20,22)/p-1