6-[[4-[5-bromanyl-3-(2H-1,2,3,4-tetrazol-5-yl)furan-2-yl]phenyl]methyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

Systemtic Name: 6-[[4-[5-bromanyl-3-(2H-1,2,3,4-tetrazol-5-yl)furan-2-yl]phenyl]methyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one Openeye Name: 6-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one CAS Name: 6-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furanyl]phenyl]methyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one IUPAC Name: 6-[[4-[5-bromo-3-(2H-tetrazol-5-yl)furan-2-yl]phenyl]methyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one Traditional Name: 6-[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]benzyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one Formula: C20H17BrN8O2 MolecularWeight: 481.30538

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N=C2N1NC=N2)CC3=CC=C(C=C3)C4=C(C=C(O4)Br)C5=NNN=N5

Isomeric SMILES

CCCC1=C(C(=O)N=C2N1NC=N2)CC3=CC=C(C=C3)C4=C(C=C(O4)Br)C5=NNN=N5

InChI

InChI=1S/C20H17BrN8O2/c1-2-3-15-13(19(30)24-20-22-10-23-29(15)20)8-11-4-6-12(7-5-11)17-14(9-16(21)31-17)18-25-27-28-26-18/h4-7,9-10H,2-3,8H2,1H3,(H,22,23,24,30)(H,25,26,27,28)