(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-[2,5-bis(oxidanylidene)imidazolidin-1-yl]butanoate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-[2,5-bis(oxidanylidene)imidazolidin-1-yl]butanoate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 4-(2,5-dioxoimidazolidin-1-yl)butanoate CAS Name: 4-(2,5-dioxo-1-imidazolidinyl)butanoic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 4-(2,5-dioxoimidazolidin-1-yl)butanoate Traditional Name: 4-(2,5-diketoimidazolidin-1-yl)butyric acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C18H18ClN3O4S MolecularWeight: 407.87122

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CCCN3C(=O)CNC3=O)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CCCN3C(=O)CNC3=O)Cl

InChI

InChI=1S/C18H18ClN3O4S/c1-27-13-5-4-11-7-12(17(19)21-14(11)8-13)10-26-16(24)3-2-6-22-15(23)9-20-18(22)25/h4-5,7-8H,2-3,6,9-10H2,1H3,(H,20,25)