2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-[4-[bis(fluoranyl)methoxy]phenyl]quinazolin-4-one

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-[4-[bis(fluoranyl)methoxy]phenyl]quinazolin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-[4-(difluoromethoxy)phenyl]quinazolin-4-one CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-3-[4-(difluoromethoxy)phenyl]-4-quinazolinone IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-[4-(difluoromethoxy)phenyl]quinazolin-4-one Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-3-[4-(difluoromethoxy)phenyl]quinazolin-4-one Formula: C23H16F2N4O2S MolecularWeight: 450.460546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC(F)F

InChI

InChI=1S/C23H16F2N4O2S/c24-22(25)31-15-11-9-14(10-12-15)29-21(30)16-5-1-2-6-17(16)28-23(29)32-13-20-26-18-7-3-4-8-19(18)27-20/h1-12,22H,13H2,(H,26,27)