4-[2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[4-keto-2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]quinazolin-3-yl]benzonitrile Formula: C26H17N3O4S MolecularWeight: 467.49588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H17N3O4S/c1-32-19-10-11-20-17(12-24(30)33-23(20)13-19)15-34-26-28-22-5-3-2-4-21(22)25(31)29(26)18-8-6-16(14-27)7-9-18/h2-13H,15H2,1H3