4-(1,3-dithian-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(1,3-dithian-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-(2,4,5-trimethoxybenzyl)benzamide Formula: C21H25NO4S2 MolecularWeight: 419.5575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC=C(C=C2)C3SCCCS3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC=C(C=C2)C3SCCCS3)OC)OC

InChI

InChI=1S/C21H25NO4S2/c1-24-17-12-19(26-3)18(25-2)11-16(17)13-22-20(23)14-5-7-15(8-6-14)21-27-9-4-10-28-21/h5-8,11-12,21H,4,9-10,13H2,1-3H3,(H,22,23)