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

Systemtic Name: 2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[3-(5-bromo-3-pyridinyl)-1H-1,2,4-triazol-5-yl]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]-N-[2-(2-thienyl)ethyl]acetamide Formula: C15H14BrN5OS MolecularWeight: 392.27356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)CC2=NC(=NN2)C3=CC(=CN=C3)Br

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)CC2=NC(=NN2)C3=CC(=CN=C3)Br

InChI

InChI=1S/C15H14BrN5OS/c16-11-6-10(8-17-9-11)15-19-13(20-21-15)7-14(22)18-4-3-12-2-1-5-23-12/h1-2,5-6,8-9H,3-4,7H2,(H,18,22)(H,19,20,21)