4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(2,4,5-trimethoxybenzyl)benzamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3)OC)OC

InChI

InChI=1S/C25H25N3O4S/c1-30-21-13-23(32-3)22(31-2)12-18(21)14-26-24(29)17-10-8-16(9-11-17)15-33-25-27-19-6-4-5-7-20(19)28-25/h4-13H,14-15H2,1-3H3,(H,26,29)(H,27,28)