N-tert-butyl-2-(3-cyano-8-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-(3-cyano-8-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-[(3-cyano-8-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-tert-butyl-2-[(3-cyano-8-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-tert-butyl-2-(3-cyano-8-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(3-cyano-8-methyl-2-quinolyl)thio]acetamide Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C(=C2)C#N)SCC(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C(=C2)C#N)SCC(=O)NC(C)(C)C

InChI

InChI=1S/C17H19N3OS/c1-11-6-5-7-12-8-13(9-18)16(19-15(11)12)22-10-14(21)20-17(2,3)4/h5-8H,10H2,1-4H3,(H,20,21)