N-[(2S)-3-methylbutan-2-yl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-2-(2-quinolylthio)acetamide Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSC1=NC2=CC=CC=C2C=C1

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CSC1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C16H20N2OS/c1-11(2)12(3)17-15(19)10-20-16-9-8-13-6-4-5-7-14(13)18-16/h4-9,11-12H,10H2,1-3H3,(H,17,19)/t12-/m0/s1