N-[(2S)-butan-2-yl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-methylpropyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(1S)-1-methylpropyl]-2-(2-thienyl)cinchoninamide Formula: C18H18N2OS MolecularWeight: 310.41332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C18H18N2OS/c1-3-12(2)19-18(21)14-11-16(17-9-6-10-22-17)20-15-8-5-4-7-13(14)15/h4-12H,3H2,1-2H3,(H,19,21)/t12-/m0/s1