ethyl 1-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]piperidine-3-carboxylate CAS Name: 1-[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methylquinolin-2-yl)sulfanylacetyl]piperidine-3-carboxylate Traditional Name: 1-[2-[(4-methyl-2-quinolyl)thio]acetyl]nipecotic acid ethyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C20H24N2O3S/c1-3-25-20(24)15-7-6-10-22(12-15)19(23)13-26-18-11-14(2)16-8-4-5-9-17(16)21-18/h4-5,8-9,11,15H,3,6-7,10,12-13H2,1-2H3