3-[[3-[4-[bis(fluoranyl)methoxy]phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[3-[4-[bis(fluoranyl)methoxy]phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[3-[4-(difluoromethoxy)phenyl]-4-oxo-quinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[[3-[4-(difluoromethoxy)phenyl]-4-oxo-2-quinazolinyl]thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[3-[4-(difluoromethoxy)phenyl]-4-oxoquinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[[3-[4-(difluoromethoxy)phenyl]-4-keto-quinazolin-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one Formula: C23H15F2N5O3S MolecularWeight: 479.458706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCN3C(=O)C4=CC=CC=C4N=N3)C5=CC=C(C=C5)OC(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCN3C(=O)C4=CC=CC=C4N=N3)C5=CC=C(C=C5)OC(F)F

InChI

InChI=1S/C23H15F2N5O3S/c24-22(25)33-15-11-9-14(10-12-15)30-21(32)16-5-1-3-7-18(16)26-23(30)34-13-29-20(31)17-6-2-4-8-19(17)27-28-29/h1-12,22H,13H2