ethyl 4-[2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(1-methyl-2-oxo-4-quinolinyl)thio]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(2-keto-1-methyl-4-quinolyl)thio]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=CC(=O)N(C3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=CC(=O)N(C3=CC=CC=C32)C

InChI

InChI=1S/C20H25N3O4S/c1-3-27-20(26)23-10-8-14(9-11-23)21-18(24)13-28-17-12-19(25)22(2)16-7-5-4-6-15(16)17/h4-7,12,14H,3,8-11,13H2,1-2H3,(H,21,24)