3-bromanyl-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)benzamide

Systemtic Name: 3-bromanyl-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)benzamide Openeye Name: 3-bromo-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)benzamide CAS Name: 3-bromo-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)benzamide IUPAC Name: 3-bromo-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)benzamide Traditional Name: 3-bromo-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)benzamide Formula: C13H13BrN4O MolecularWeight: 321.17252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NN=C(N2C1)CNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CC2=NN=C(N2C1)CNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C13H13BrN4O/c14-10-4-1-3-9(7-10)13(19)15-8-12-17-16-11-5-2-6-18(11)12/h1,3-4,7H,2,5-6,8H2,(H,15,19)