(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanoate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 2-[2-(2-oxopyrrolidin-1-yl)thiazol-4-yl]acetate CAS Name: 2-[2-(2-oxo-1-pyrrolidinyl)-4-thiazolyl]acetic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(2-ketopyrrolidino)thiazol-4-yl]acetic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C20H18ClN3O3S2 MolecularWeight: 447.95822

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CC3=CSC(=N3)N4CCCC4=O)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CC3=CSC(=N3)N4CCCC4=O)Cl

InChI

InChI=1S/C20H18ClN3O3S2/c1-28-15-5-4-12-7-13(19(21)23-16(12)9-15)10-27-18(26)8-14-11-29-20(22-14)24-6-2-3-17(24)25/h4-5,7,9,11H,2-3,6,8,10H2,1H3