N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC(C)(C#N)C3CC3

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)N[C@](C)(C#N)C3CC3

InChI

InChI=1S/C19H21N3OS/c1-12-5-4-6-15-13(2)9-17(21-18(12)15)24-10-16(23)22-19(3,11-20)14-7-8-14/h4-6,9,14H,7-8,10H2,1-3H3,(H,22,23)/t19-/m1/s1