3-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(4-oxo-3-phenyl-2-quinazolinyl)thio]methyl]benzonitrile IUPAC Name: 3-[(4-oxo-3-phenylquinazolin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(4-keto-3-phenyl-quinazolin-2-yl)thio]methyl]benzonitrile Formula: C22H15N3OS MolecularWeight: 369.439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H15N3OS/c23-14-16-7-6-8-17(13-16)15-27-22-24-20-12-5-4-11-19(20)21(26)25(22)18-9-2-1-3-10-18/h1-13H,15H2