2-[(5-oxo-9-phenyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,6-trien-3-yl)methylsulfanyl]-1H-quinazolin-4-one

Molecular Formula: C20H14N6O2S


InChI: InChI=1/C20H14N6O2S/c27-18-13-8-4-5-9-15(13)22-20(25-18)29-11-16-23-17-14(19(28)24-16)10-21-26(17)12-6-2-1-3-7-12/h1-10,21H,11H2,(H,22,25,27)/f/h22H

InChIKey: InChIKey=XXPVOJZZNBMYCU-QWOVJGMICG
SMILES: C1=CC=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)CSC4=NC(=O)C5=CC=CC=C5N4

Names:
    2-[(5-oxo-9-phenyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,6-trien-3-yl)methylsulfanyl]-1H-quinazolin-4-one

Registries:
    PubChem CID 993508
    PubChem ID 6081977