9-(3-bromophenyl)-2-pyridin-4-yl-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one

Systemtic Name: 9-(3-bromophenyl)-2-pyridin-4-yl-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one Openeye Name: 9-(3-bromophenyl)-2-(4-pyridyl)-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one CAS Name: 9-(3-bromophenyl)-2-pyridin-4-yl-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one IUPAC Name: 9-(3-bromophenyl)-2-pyridin-4-yl-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one Traditional Name: 9-(3-bromophenyl)-2-(4-pyridyl)-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one Formula: C20H16BrN5O MolecularWeight: 422.27794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(N3C(=N2)N=C(N3)C4=CC=NC=C4)C5=CC(=CC=C5)Br)C(=O)C1

Isomeric SMILES

C1CC2=C(C(N3C(=N2)N=C(N3)C4=CC=NC=C4)C5=CC(=CC=C5)Br)C(=O)C1

InChI

InChI=1S/C20H16BrN5O/c21-14-4-1-3-13(11-14)18-17-15(5-2-6-16(17)27)23-20-24-19(25-26(18)20)12-7-9-22-10-8-12/h1,3-4,7-11,18H,2,5-6H2,(H,23,24,25)