N-(2-cyanoethyl)-N-methyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(4-oxo-1H-quinazolin-2-yl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-keto-1H-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C14H14N4O2S/c1-18(8-4-7-15)12(19)9-21-14-16-11-6-3-2-5-10(11)13(20)17-14/h2-3,5-6H,4,8-9H2,1H3,(H,16,17,20)