N-cyclopropyl-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-2-methyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-cyclopropyl-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-2-methyl-1,3-thiazole-4-carboxamide Openeye Name: N-cyclopropyl-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-3-quinolyl]methyl]-2-methyl-thiazole-4-carboxamide CAS Name: N-cyclopropyl-N-[[2-(3-methoxyphenyl)-7-(methylthio)-3-quinolinyl]methyl]-2-methyl-4-thiazolecarboxamide IUPAC Name: N-cyclopropyl-N-[[2-(3-methoxyphenyl)-7-methylsulfanylquinolin-3-yl]methyl]-2-methyl-1,3-thiazole-4-carboxamide Traditional Name: N-cyclopropyl-N-[[2-(3-methoxyphenyl)-7-(methylthio)-3-quinolyl]methyl]-2-methyl-thiazole-4-carboxamide Formula: C26H25N3O2S2 MolecularWeight: 475.6256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)N(CC2=C(N=C3C=C(C=CC3=C2)SC)C4=CC(=CC=C4)OC)C5CC5

Isomeric SMILES

CC1=NC(=CS1)C(=O)N(CC2=C(N=C3C=C(C=CC3=C2)SC)C4=CC(=CC=C4)OC)C5CC5

InChI

InChI=1S/C26H25N3O2S2/c1-16-27-24(15-33-16)26(30)29(20-8-9-20)14-19-11-17-7-10-22(32-3)13-23(17)28-25(19)18-5-4-6-21(12-18)31-2/h4-7,10-13,15,20H,8-9,14H2,1-3H3