4-[2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[4-keto-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]quinazolin-3-yl]benzonitrile Formula: C24H16N4O5S MolecularWeight: 472.47264

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N)[N+](=O)[O-]

InChI

InChI=1S/C24H16N4O5S/c25-11-15-5-7-18(8-6-15)27-23(29)20-3-1-2-4-21(20)26-24(27)34-13-17-10-19(28(30)31)9-16-12-32-14-33-22(16)17/h1-10H,12-14H2