N-(3-methoxypropyl)-N-[[2-(3-methylphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-1,3-thiazole-5-carboxamide

Systemtic Name: N-(3-methoxypropyl)-N-[[2-(3-methylphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-1,3-thiazole-5-carboxamide Openeye Name: N-(3-methoxypropyl)-N-[[7-methylsulfanyl-2-(m-tolyl)-3-quinolyl]methyl]thiazole-5-carboxamide CAS Name: N-(3-methoxypropyl)-N-[[2-(3-methylphenyl)-7-(methylthio)-3-quinolinyl]methyl]-5-thiazolecarboxamide IUPAC Name: N-(3-methoxypropyl)-N-[[2-(3-methylphenyl)-7-methylsulfanylquinolin-3-yl]methyl]-1,3-thiazole-5-carboxamide Traditional Name: N-(3-methoxypropyl)-N-[[7-(methylthio)-2-(m-tolyl)-3-quinolyl]methyl]thiazole-5-carboxamide Formula: C26H27N3O2S2 MolecularWeight: 477.64148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C=C3C=CC(=CC3=N2)SC)CN(CCCOC)C(=O)C4=CN=CS4

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C=C3C=CC(=CC3=N2)SC)CN(CCCOC)C(=O)C4=CN=CS4

InChI

InChI=1S/C26H27N3O2S2/c1-18-6-4-7-20(12-18)25-21(13-19-8-9-22(32-3)14-23(19)28-25)16-29(10-5-11-31-2)26(30)24-15-27-17-33-24/h4,6-9,12-15,17H,5,10-11,16H2,1-3H3