1-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-(4-methylquinolin-2-yl)sulfanylacetyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-[(4-methyl-2-quinolyl)thio]acetyl]-N-phenyl-nipecotamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O2S/c1-17-14-22(26-21-12-6-5-11-20(17)21)30-16-23(28)27-13-7-8-18(15-27)24(29)25-19-9-3-2-4-10-19/h2-6,9-12,14,18H,7-8,13,15-16H2,1H3,(H,25,29)