2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(2,4,5-trimethoxybenzyl)benzamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3)OC)OC

InChI

InChI=1S/C25H24N2O5S/c1-29-21-13-23(31-3)22(30-2)12-17(21)14-26-24(28)18-9-5-4-8-16(18)15-33-25-27-19-10-6-7-11-20(19)32-25/h4-13H,14-15H2,1-3H3,(H,26,28)