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

Systemtic Name: 1-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-methylquinolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(4-methyl-2-quinolyl)thio]acetyl]isonipecotamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C18H21N3O2S/c1-12-10-16(20-15-5-3-2-4-14(12)15)24-11-17(22)21-8-6-13(7-9-21)18(19)23/h2-5,10,13H,6-9,11H2,1H3,(H2,19,23)