N-(2-cyanoethyl)-N-methyl-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CCC#N

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CCC#N

InChI

InChI=1S/C17H20N4O2S/c1-12(2)21-16(23)13-7-4-5-8-14(13)19-17(21)24-11-15(22)20(3)10-6-9-18/h4-5,7-8,12H,6,10-11H2,1-3H3