N-cyclopentyl-2-[(3-methylsulfanylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-cyclopentyl-2-[(3-methylsulfanylphenyl)amino]quinoline-4-carboxamide Openeye Name: N-cyclopentyl-2-(3-methylsulfanylanilino)quinoline-4-carboxamide CAS Name: N-cyclopentyl-2-[3-(methylthio)anilino]-4-quinolinecarboxamide IUPAC Name: N-cyclopentyl-2-(3-methylsulfanylanilino)quinoline-4-carboxamide Traditional Name: N-cyclopentyl-2-[3-(methylthio)anilino]cinchoninamide Formula: C22H23N3OS MolecularWeight: 377.50252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCCC4

Isomeric SMILES

CSC1=CC=CC(=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCCC4

InChI

InChI=1S/C22H23N3OS/c1-27-17-10-6-9-16(13-17)23-21-14-19(18-11-4-5-12-20(18)25-21)22(26)24-15-7-2-3-8-15/h4-6,9-15H,2-3,7-8H2,1H3,(H,23,25)(H,24,26)