2-azanyl-N-[[2-(4-bromanyl-2-pyridin-2-ylcarbonyl-phenyl)-5-pyrrolidin-1-ylcarbonyl-1,2,4-triazol-3-yl]methyl]ethanamide

Systemtic Name: 2-azanyl-N-[[2-(4-bromanyl-2-pyridin-2-ylcarbonyl-phenyl)-5-pyrrolidin-1-ylcarbonyl-1,2,4-triazol-3-yl]methyl]ethanamide Openeye Name: 2-amino-N-[[2-[4-bromo-2-(pyridine-2-carbonyl)phenyl]-5-(pyrrolidine-1-carbonyl)-1,2,4-triazol-3-yl]methyl]acetamide CAS Name: 2-amino-N-[[2-[4-bromo-2-[oxo(2-pyridinyl)methyl]phenyl]-5-[oxo(1-pyrrolidinyl)methyl]-1,2,4-triazol-3-yl]methyl]acetamide IUPAC Name: 2-amino-N-[[2-[4-bromo-2-(pyridine-2-carbonyl)phenyl]-5-(pyrrolidine-1-carbonyl)-1,2,4-triazol-3-yl]methyl]acetamide Traditional Name: 2-amino-N-[[2-(4-bromo-2-picolinoyl-phenyl)-5-(pyrrolidine-1-carbonyl)-1,2,4-triazol-3-yl]methyl]acetamide Formula: C22H22BrN7O3 MolecularWeight: 512.35918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=NN(C(=N2)CNC(=O)CN)C3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)C(=O)C2=NN(C(=N2)CNC(=O)CN)C3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C22H22BrN7O3/c23-14-6-7-17(15(11-14)20(32)16-5-1-2-8-25-16)30-18(13-26-19(31)12-24)27-21(28-30)22(33)29-9-3-4-10-29/h1-2,5-8,11H,3-4,9-10,12-13,24H2,(H,26,31)