3,5-bis(bromanyl)-N-(2-chloranyl-4-isothiocyanato-phenyl)-2-oxidanyl-benzamide

Systemtic Name: 3,5-bis(bromanyl)-N-(2-chloranyl-4-isothiocyanato-phenyl)-2-oxidanyl-benzamide Openeye Name: 3,5-dibromo-N-(2-chloro-4-isothiocyanato-phenyl)-2-hydroxy-benzamide CAS Name: 3,5-dibromo-N-(2-chloro-4-isothiocyanatophenyl)-2-hydroxybenzamide IUPAC Name: 3,5-dibromo-N-(2-chloro-4-isothiocyanatophenyl)-2-hydroxybenzamide Traditional Name: 3,5-dibromo-N-(2-chloro-4-isothiocyanato-phenyl)-2-hydroxy-benzamide Formula: C14H7Br2ClN2O2S MolecularWeight: 462.54358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=C=S)Cl)NC(=O)C2=CC(=CC(=C2O)Br)Br

Isomeric SMILES

C1=CC(=C(C=C1N=C=S)Cl)NC(=O)C2=CC(=CC(=C2O)Br)Br

InChI

InChI=1S/C14H7Br2ClN2O2S/c15-7-3-9(13(20)10(16)4-7)14(21)19-12-2-1-8(18-6-22)5-11(12)17/h1-5,20H,(H,19,21)