N-[[(2S)-butan-2-yl]carbamoyl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-(2-quinolylthio)acetamide Formula: C16H19N3O2S MolecularWeight: 317.40596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O2S/c1-3-11(2)17-16(21)19-14(20)10-22-15-9-8-12-6-4-5-7-13(12)18-15/h4-9,11H,3,10H2,1-2H3,(H2,17,19,20,21)/t11-/m0/s1