4-[2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanylethoxy]benzonitrile CAS Name: 4-[2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]ethoxy]benzonitrile Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H19N3O2S/c25-16-18-10-12-20(13-11-18)29-14-15-30-24-26-22-9-5-4-8-21(22)23(28)27(24)17-19-6-2-1-3-7-19/h1-13H,14-15,17H2