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

Systemtic Name: 2,6-bis(bromanyl)-4-[(4-bromophenyl)carbonylcarbamothioylamino]phenolate Openeye Name: 2,6-dibromo-4-[(4-bromobenzoyl)carbamothioylamino]phenolate CAS Name: 2,6-dibromo-4-[[[[(4-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dibromo-4-[(4-bromobenzoyl)carbamothioylamino]phenolate Traditional Name: 2,6-dibromo-4-[(4-bromobenzoyl)thiocarbamoylamino]phenolate Formula: C14H8Br3N2O2S- MolecularWeight: 508.00252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br)Br

InChI

InChI=1S/C14H9Br3N2O2S/c15-8-3-1-7(2-4-8)13(21)19-14(22)18-9-5-10(16)12(20)11(17)6-9/h1-6,20H,(H2,18,19,21,22)/p-1