3-bromanyl-N-[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide

Systemtic Name: 3-bromanyl-N-[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Openeye Name: 3-bromo-N-[4-(3-oxo-3-pyrrolidin-1-yl-propyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide CAS Name: 3-bromo-N-[4-[3-oxo-3-(1-pyrrolidinyl)propyl]phenyl]-6-(1,2,4-triazol-4-yl)-2-pyridinecarboxamide IUPAC Name: 3-bromo-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Traditional Name: 3-bromo-N-[4-(3-keto-3-pyrrolidino-propyl)phenyl]-6-(1,2,4-triazol-4-yl)picolinamide Formula: C21H21BrN6O2 MolecularWeight: 469.33444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

Isomeric SMILES

C1CCN(C1)C(=O)CCC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

InChI

InChI=1S/C21H21BrN6O2/c22-17-8-9-18(28-13-23-24-14-28)26-20(17)21(30)25-16-6-3-15(4-7-16)5-10-19(29)27-11-1-2-12-27/h3-4,6-9,13-14H,1-2,5,10-12H2,(H,25,30)