N-(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-N-phenyl-propanamide

Systemtic Name: N-(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-N-phenyl-propanamide Openeye Name: N-(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[(2-methyl-4-quinazolinyl)thio]-N-phenylpropanamide IUPAC Name: N-(2-cyanoethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-N-phenylpropanamide Traditional Name: N-(2-cyanoethyl)-2-[(2-methylquinazolin-4-yl)thio]-N-phenyl-propionamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4OS/c1-15(21(26)25(14-8-13-22)17-9-4-3-5-10-17)27-20-18-11-6-7-12-19(18)23-16(2)24-20/h3-7,9-12,15H,8,14H2,1-2H3