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

Systemtic Name: 2-[[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]methyl]benzonitrile IUPAC Name: 2-[[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]methyl]benzonitrile Formula: C23H14N4OS MolecularWeight: 394.44846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H14N4OS/c24-13-16-9-11-19(12-10-16)27-22(28)20-7-3-4-8-21(20)26-23(27)29-15-18-6-2-1-5-17(18)14-25/h1-12H,15H2