2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]acetamide CAS Name: 2-[3-(5-bromo-3-pyridinyl)-1H-1,2,4-triazol-5-yl]-N-prop-2-enylacetamide IUPAC Name: 2-[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]acetamide Formula: C12H12BrN5O MolecularWeight: 322.16058

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CC1=NC(=NN1)C2=CC(=CN=C2)Br

Isomeric SMILES

C=CCNC(=O)CC1=NC(=NN1)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H12BrN5O/c1-2-3-15-11(19)5-10-16-12(18-17-10)8-4-9(13)7-14-6-8/h2,4,6-7H,1,3,5H2,(H,15,19)(H,16,17,18)