2,6-bis(chloranyl)-4-[(4-phenylmethoxyphenyl)carbonylcarbamothioylamino]phenolate

Systemtic Name: 2,6-bis(chloranyl)-4-[(4-phenylmethoxyphenyl)carbonylcarbamothioylamino]phenolate Openeye Name: 4-[(4-benzyloxybenzoyl)carbamothioylamino]-2,6-dichloro-phenolate CAS Name: 2,6-dichloro-4-[[[[oxo-(4-phenylmethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dichloro-4-[(4-phenylmethoxybenzoyl)carbamothioylamino]phenolate Traditional Name: 4-[(4-benzoxybenzoyl)thiocarbamoylamino]-2,6-dichloro-phenolate Formula: C21H15Cl2N2O3S- MolecularWeight: 446.3264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)[O-])Cl

InChI

InChI=1S/C21H16Cl2N2O3S/c22-17-10-15(11-18(23)19(17)26)24-21(29)25-20(27)14-6-8-16(9-7-14)28-12-13-4-2-1-3-5-13/h1-11,26H,12H2,(H2,24,25,27,29)/p-1