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

Systemtic Name: 3-bromanyl-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-bromo-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-bromo-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-bromo-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-bromo-N-[2-(1,2,4-triazol-1-ylmethyl)benzyl]benzamide Formula: C17H15BrN4O MolecularWeight: 371.2312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN4O/c18-16-7-3-6-13(8-16)17(23)20-9-14-4-1-2-5-15(14)10-22-12-19-11-21-22/h1-8,11-12H,9-10H2,(H,20,23)