1-[2-(4-methyl-8-propan-2-yl-quinolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(4-methyl-8-propan-2-yl-quinolin-2-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(8-isopropyl-4-methyl-2-quinolyl)sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(4-methyl-8-propan-2-yl-2-quinolinyl)thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-methyl-8-propan-2-ylquinolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(8-isopropyl-4-methyl-2-quinolyl)thio]acetyl]isonipecotamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2C(C)C)SCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2C(C)C)SCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H27N3O2S/c1-13(2)16-5-4-6-17-14(3)11-18(23-20(16)17)27-12-19(25)24-9-7-15(8-10-24)21(22)26/h4-6,11,13,15H,7-10,12H2,1-3H3,(H2,22,26)