ethyl 4-[2-(6-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(6-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(6-chloro-1-methyl-2-oxo-4-quinolyl)sulfanyl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(6-chloro-1-methyl-2-oxo-4-quinolinyl)thio]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(6-chloro-1-methyl-2-oxoquinolin-4-yl)sulfanylacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(6-chloro-2-keto-1-methyl-4-quinolyl)thio]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H24ClN3O4S MolecularWeight: 437.94026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=CC(=O)N(C3=C2C=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CSC2=CC(=O)N(C3=C2C=C(C=C3)Cl)C

InChI

InChI=1S/C20H24ClN3O4S/c1-3-28-20(27)24-8-6-14(7-9-24)22-18(25)12-29-17-11-19(26)23(2)16-5-4-13(21)10-15(16)17/h4-5,10-11,14H,3,6-9,12H2,1-2H3,(H,22,25)