2-(5-chloranylthiophen-2-yl)-N-[(1R)-1-pyridin-4-ylethyl]quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-[(1R)-1-pyridin-4-ylethyl]quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-[(1R)-1-(4-pyridyl)ethyl]quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-[(1R)-1-pyridin-4-ylethyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-[(1R)-1-pyridin-4-ylethyl]quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-[(1R)-1-(4-pyridyl)ethyl]cinchoninamide Formula: C21H16ClN3OS MolecularWeight: 393.88924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl

Isomeric SMILES

C[C@H](C1=CC=NC=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H16ClN3OS/c1-13(14-8-10-23-11-9-14)24-21(26)16-12-18(19-6-7-20(22)27-19)25-17-5-3-2-4-15(16)17/h2-13H,1H3,(H,24,26)/t13-/m1/s1