N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: 2-[4-(2-thienylsulfonyl)piperazino]-N-veratryl-acetamide Formula: C19H25N3O5S2 MolecularWeight: 439.5489

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C19H25N3O5S2/c1-26-16-6-5-15(12-17(16)27-2)13-20-18(23)14-21-7-9-22(10-8-21)29(24,25)19-4-3-11-28-19/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,20,23)