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

Systemtic Name: ethyl 4-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C20H25N3O3S/c1-3-26-20(25)23-10-8-15(9-11-23)21-18(24)13-27-19-12-14(2)16-6-4-5-7-17(16)22-19/h4-7,12,15H,3,8-11,13H2,1-2H3,(H,21,24)