N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylsulfonylpiperazin-2-yl)ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylsulfonylpiperazin-2-yl)ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylsulfonylpiperazin-2-yl)acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylsulfonyl-2-piperazinyl)acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylsulfonylpiperazin-2-yl)acetamide Traditional Name: 2-(4-mesylpiperazin-2-yl)-N-veratryl-acetamide Formula: C16H25N3O5S MolecularWeight: 371.4518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CC2CN(CCN2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CC2CN(CCN2)S(=O)(=O)C)OC

InChI

InChI=1S/C16H25N3O5S/c1-23-14-5-4-12(8-15(14)24-2)10-18-16(20)9-13-11-19(7-6-17-13)25(3,21)22/h4-5,8,13,17H,6-7,9-11H2,1-3H3,(H,18,20)