2-naphthalen-2-yl-7-(4-nitrophenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

Systemtic Name: 2-naphthalen-2-yl-7-(4-nitrophenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one Openeye Name: 2-(2-naphthyl)-7-(4-nitrophenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one CAS Name: 2-(2-naphthalenyl)-7-(4-nitrophenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one IUPAC Name: 2-naphthalen-2-yl-7-(4-nitrophenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one Traditional Name: 2-(2-naphthyl)-7-(4-nitrophenyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one Formula: C21H15N5O3 MolecularWeight: 385.3755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N2C(=NC1=O)N=C(N2)C3=CC4=CC=CC=C4C=C3)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C(N2C(=NC1=O)N=C(N2)C3=CC4=CC=CC=C4C=C3)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O3/c27-19-12-18(14-7-9-17(10-8-14)26(28)29)25-21(22-19)23-20(24-25)16-6-5-13-3-1-2-4-15(13)11-16/h1-11,18H,12H2,(H,22,23,24,27)