N-(2-cyanoethyl)-N-methyl-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-methyl-2-[[2-(2-thienyl)quinazolin-4-yl]thio]acetamide Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C18H16N4OS2/c1-22(10-5-9-19)16(23)12-25-18-13-6-2-3-7-14(13)20-17(21-18)15-8-4-11-24-15/h2-4,6-8,11H,5,10,12H2,1H3