4-(2-methylsulfanylimidazol-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(2-methylsulfanylimidazol-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(2-methylsulfanylimidazol-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-[2-(methylthio)-1-imidazolyl]-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(2-methylsulfanylimidazol-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-[2-(methylthio)imidazol-1-yl]-N-(2,4,5-trimethoxybenzyl)benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC=C(C=C2)N3C=CN=C3SC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC=C(C=C2)N3C=CN=C3SC)OC)OC

InChI

InChI=1S/C21H23N3O4S/c1-26-17-12-19(28-3)18(27-2)11-15(17)13-23-20(25)14-5-7-16(8-6-14)24-10-9-22-21(24)29-4/h5-12H,13H2,1-4H3,(H,23,25)