[5-bromanyl-2-[3-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone

Systemtic Name: [5-bromanyl-2-[3-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone Openeye Name: [5-bromo-2-[3-methyl-5-(morpholinomethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone CAS Name: [5-bromo-2-[3-methyl-5-(4-morpholinylmethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridinyl)methanone IUPAC Name: [5-bromo-2-[3-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-ylmethanone Traditional Name: [5-bromo-2-[3-methyl-5-(morpholinomethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone Formula: C20H20BrN5O2 MolecularWeight: 442.3091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=N3)CN4CCOCC4

Isomeric SMILES

CC1=NN=C(N1C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=N3)CN4CCOCC4

InChI

InChI=1S/C20H20BrN5O2/c1-14-23-24-19(13-25-8-10-28-11-9-25)26(14)18-6-5-15(21)12-16(18)20(27)17-4-2-3-7-22-17/h2-7,12H,8-11,13H2,1H3