N-tert-butyl-2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-tert-butyl-2-[(3-cyano-7-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-tert-butyl-2-(3-cyano-7-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(3-cyano-7-methyl-2-quinolyl)thio]acetamide Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC(C)(C)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC(C)(C)C)C#N

InChI

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