2,6-bis(bromanyl)-4-[(3-methoxyphenyl)carbonylcarbamothioylamino]phenolate

Systemtic Name: 2,6-bis(bromanyl)-4-[(3-methoxyphenyl)carbonylcarbamothioylamino]phenolate Openeye Name: 2,6-dibromo-4-[(3-methoxybenzoyl)carbamothioylamino]phenolate CAS Name: 2,6-dibromo-4-[[[[(3-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dibromo-4-[(3-methoxybenzoyl)carbamothioylamino]phenolate Traditional Name: 2,6-dibromo-4-(m-anisoylthiocarbamoylamino)phenolate Formula: C15H11Br2N2O3S- MolecularWeight: 459.13244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br

InChI

InChI=1S/C15H12Br2N2O3S/c1-22-10-4-2-3-8(5-10)14(21)19-15(23)18-9-6-11(16)13(20)12(17)7-9/h2-7,20H,1H3,(H2,18,19,21,23)/p-1