N-(5-chloranyl-2-cyano-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C18H13ClN4OS MolecularWeight: 368.84002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C18H13ClN4OS/c1-11-21-15-5-3-2-4-14(15)18(22-11)25-10-17(24)23-16-8-13(19)7-6-12(16)9-20/h2-8H,10H2,1H3,(H,23,24)