N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C17H20N4OS/c1-11(2)17(4,10-18)21-15(22)9-23-16-13-7-5-6-8-14(13)19-12(3)20-16/h5-8,11H,9H2,1-4H3,(H,21,22)/t17-/m1/s1