4-bromanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-bromanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide CAS Name: 4-bromo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-bromo-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-bromo-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]-1H-pyrrole-2-carboxamide Formula: C15H14BrN5O MolecularWeight: 360.20856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=CN2)Br)CN3C=NC=N3

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=CN2)Br)CN3C=NC=N3

InChI

InChI=1S/C15H14BrN5O/c16-13-5-14(18-7-13)15(22)19-6-11-1-3-12(4-2-11)8-21-10-17-9-20-21/h1-5,7,9-10,18H,6,8H2,(H,19,22)