N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-chloro-2,5-dimethoxy-phenyl)acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(4-chloro-2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-chloro-2,5-dimethoxyphenyl)acetamide Traditional Name: 2-(4-besylpiperazino)-N-(4-chloro-2,5-dimethoxy-phenyl)acetamide Formula: C20H24ClN3O5S MolecularWeight: 453.93966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C20H24ClN3O5S/c1-28-18-13-17(19(29-2)12-16(18)21)22-20(25)14-23-8-10-24(11-9-23)30(26,27)15-6-4-3-5-7-15/h3-7,12-13H,8-11,14H2,1-2H3,(H,22,25)