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

Systemtic Name: [5-bromanyl-2-[3-[(dipropylamino)methyl]-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone Openeye Name: [5-bromo-2-[3-[(dipropylamino)methyl]-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone CAS Name: [5-bromo-2-[3-[(dipropylamino)methyl]-1,2,4-triazol-4-yl]phenyl]-(2-pyridinyl)methanone IUPAC Name: [5-bromo-2-[3-[(dipropylamino)methyl]-1,2,4-triazol-4-yl]phenyl]-pyridin-2-ylmethanone Traditional Name: [5-bromo-2-[3-[(dipropylamino)methyl]-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone Formula: C21H24BrN5O MolecularWeight: 442.35216

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC1=NN=CN1C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=N3

Isomeric SMILES

CCCN(CCC)CC1=NN=CN1C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=N3

InChI

InChI=1S/C21H24BrN5O/c1-3-11-26(12-4-2)14-20-25-24-15-27(20)19-9-8-16(22)13-17(19)21(28)18-7-5-6-10-23-18/h5-10,13,15H,3-4,11-12,14H2,1-2H3