2-(4-chlorophenyl)sulfanyl-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[3-(2,6-dimethyl-1-piperidyl)propyl]quinoline-4-carboxamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[3-(2,6-dimethyl-1-piperidinyl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]quinoline-4-carboxamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[3-(2,6-dimethylpiperidino)propyl]cinchoninamide Formula: C26H30ClN3OS MolecularWeight: 468.0539

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1CCCC(N1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)SC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C26H30ClN3OS/c1-18-7-5-8-19(2)30(18)16-6-15-28-26(31)23-17-25(29-24-10-4-3-9-22(23)24)32-21-13-11-20(27)12-14-21/h3-4,9-14,17-19H,5-8,15-16H2,1-2H3,(H,28,31)