N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C20H17FN4OS MolecularWeight: 380.438583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N(CCC#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N(CCC#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FN4OS/c1-14-23-18-6-3-2-5-17(18)20(24-14)27-13-19(26)25(12-4-11-22)16-9-7-15(21)8-10-16/h2-3,5-10H,4,12-13H2,1H3