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

Systemtic Name: 4-bromanyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide CAS Name: 4-bromo-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-bromo-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-bromo-N-[4-(pyrazol-1-ylmethyl)benzyl]-1H-pyrrole-2-carboxamide Formula: C16H15BrN4O MolecularWeight: 359.2205

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CN3)Br

Isomeric SMILES

C1=CN(N=C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C16H15BrN4O/c17-14-8-15(18-10-14)16(22)19-9-12-2-4-13(5-3-12)11-21-7-1-6-20-21/h1-8,10,18H,9,11H2,(H,19,22)