(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-[(2-chlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-[(2-chlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2-chlorobenzoyl)amino]-4-(methylthio)butyric acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C23H22Cl2N2O4S MolecularWeight: 493.40278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C23H22Cl2N2O4S/c1-30-16-8-7-14-11-15(21(25)26-20(14)12-16)13-31-23(29)19(9-10-32-2)27-22(28)17-5-3-4-6-18(17)24/h3-8,11-12,19H,9-10,13H2,1-2H3,(H,27,28)