5-bromanyl-2-oxidanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 5-bromanyl-2-oxidanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 5-bromo-2-hydroxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 5-bromo-2-hydroxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide IUPAC Name: 5-bromo-2-hydroxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 5-bromo-2-hydroxy-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]benzamide Formula: C17H15BrN4O2 MolecularWeight: 387.2306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=C(C=CC(=C2)Br)O)CN3C=NC=N3

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=C(C=CC(=C2)Br)O)CN3C=NC=N3

InChI

InChI=1S/C17H15BrN4O2/c18-14-5-6-16(23)15(7-14)17(24)20-8-12-1-3-13(4-2-12)9-22-11-19-10-21-22/h1-7,10-11,23H,8-9H2,(H,20,24)