N-[1-azanyl-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-oxidanylidene-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[1-azanyl-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-1-oxidanylidene-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-amino-1-[(3,5-dibromo-4-hydroxy-phenyl)methyl]-2-oxo-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-amino-3-(3,5-dibromo-4-hydroxyphenyl)-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-amino-3-(3,5-dibromo-4-hydroxyphenyl)-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-amino-1-(3,5-dibromo-4-hydroxy-benzyl)-2-keto-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C22H17Br2N5O3 MolecularWeight: 559.21008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NC(CC3=CC(=C(C(=C3)Br)O)Br)C(=O)N)NC(=N2)C4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(C=C1C(=O)NC(CC3=CC(=C(C(=C3)Br)O)Br)C(=O)N)NC(=N2)C4=CC=NC=C4

InChI

InChI=1S/C22H17Br2N5O3/c23-14-7-11(8-15(24)19(14)30)9-18(20(25)31)29-22(32)13-1-2-16-17(10-13)28-21(27-16)12-3-5-26-6-4-12/h1-8,10,18,30H,9H2,(H2,25,31)(H,27,28)(H,29,32)