N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,3-dithian-2-yl)benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,3-dithian-2-yl)benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,3-dithian-2-yl)benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,3-dithian-2-yl)benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,3-dithian-2-yl)benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-homoveratryl-benzamide Formula: C21H25NO3S2 MolecularWeight: 403.5581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C3SCCCS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C3SCCCS3)OC

InChI

InChI=1S/C21H25NO3S2/c1-24-18-9-4-15(14-19(18)25-2)10-11-22-20(23)16-5-7-17(8-6-16)21-26-12-3-13-27-21/h4-9,14,21H,3,10-13H2,1-2H3,(H,22,23)