N-(cyanomethyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide

Systemtic Name: N-(cyanomethyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: N-(cyanomethyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N-phenyl-acetamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CC#N)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CC#N)C3=CC=CC=C3

InChI

InChI=1S/C20H18N4O2S/c1-2-23-19(26)16-10-6-7-11-17(16)22-20(23)27-14-18(25)24(13-12-21)15-8-4-3-5-9-15/h3-11H,2,13-14H2,1H3