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

Systemtic Name: 2,6-bis(bromanyl)-4-[(4-tert-butylphenyl)carbonylcarbamothioylamino]phenolate Openeye Name: 2,6-dibromo-4-[(4-tert-butylbenzoyl)carbamothioylamino]phenolate CAS Name: 2,6-dibromo-4-[[[[(4-tert-butylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dibromo-4-[(4-tert-butylbenzoyl)carbamothioylamino]phenolate Traditional Name: 2,6-dibromo-4-[(4-tert-butylbenzoyl)thiocarbamoylamino]phenolate Formula: C18H17Br2N2O2S- MolecularWeight: 485.21278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Br2N2O2S/c1-18(2,3)11-6-4-10(5-7-11)16(24)22-17(25)21-12-8-13(19)15(23)14(20)9-12/h4-9,23H,1-3H3,(H2,21,22,24,25)/p-1