4-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)benzenecarbonitrile

Systemtic Name: 4-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)benzenecarbonitrile Openeye Name: 4-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)benzonitrile CAS Name: 4-[4-oxo-2-(phenacylthio)-3-quinazolinyl]benzonitrile IUPAC Name: 4-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)benzonitrile Traditional Name: 4-[4-keto-2-(phenacylthio)quinazolin-3-yl]benzonitrile Formula: C23H15N3O2S MolecularWeight: 397.4491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H15N3O2S/c24-14-16-10-12-18(13-11-16)26-22(28)19-8-4-5-9-20(19)25-23(26)29-15-21(27)17-6-2-1-3-7-17/h1-13H,15H2