2-(4-methylquinolin-2-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-N-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-(4-piperidinosulfonylphenyl)propionamide Formula: C24H27N3O3S2 MolecularWeight: 469.61948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H27N3O3S2/c1-17-16-23(26-22-9-5-4-8-21(17)22)31-18(2)24(28)25-19-10-12-20(13-11-19)32(29,30)27-14-6-3-7-15-27/h4-5,8-13,16,18H,3,6-7,14-15H2,1-2H3,(H,25,28)