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

Systemtic Name: 3-[(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(3-ethyl-4-oxo-2-quinazolinyl)thio]methyl]benzonitrile IUPAC Name: 3-[(3-ethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(3-ethyl-4-keto-quinazolin-2-yl)thio]methyl]benzonitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC(=C3)C#N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H15N3OS/c1-2-21-17(22)15-8-3-4-9-16(15)20-18(21)23-12-14-7-5-6-13(10-14)11-19/h3-10H,2,12H2,1H3