4-[4-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[4-oxo-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-3-yl]benzonitrile CAS Name: 4-[4-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-quinazolinyl]benzonitrile IUPAC Name: 4-[4-oxo-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-3-yl]benzonitrile Traditional Name: 4-[4-keto-2-[(2-keto-2-piperidino-ethyl)thio]quinazolin-3-yl]benzonitrile Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H20N4O2S/c23-14-16-8-10-17(11-9-16)26-21(28)18-6-2-3-7-19(18)24-22(26)29-15-20(27)25-12-4-1-5-13-25/h2-3,6-11H,1,4-5,12-13,15H2