N-(5-chloranyl-2-methoxy-phenyl)-2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-methyl-amino]ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-methyl-amino]ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl-methyl-amino]acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl-methylamino]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl-methylamino]acetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[2-chloro-7-(methylthio)-3-quinolyl]methyl-methyl-amino]acetamide Formula: C21H21Cl2N3O2S MolecularWeight: 450.38134

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CN(CC1=C(N=C2C=C(C=CC2=C1)SC)Cl)CC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H21Cl2N3O2S/c1-26(12-20(27)24-18-9-15(22)5-7-19(18)28-2)11-14-8-13-4-6-16(29-3)10-17(13)25-21(14)23/h4-10H,11-12H2,1-3H3,(H,24,27)