2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-N-(3,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-[4-(2-cyanophenyl)sulfonyl-1-piperazinyl]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-[4-(2-cyanophenyl)sulfonylpiperazino]-N-(3,5-dimethoxyphenyl)acetamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)OC

InChI

InChI=1S/C21H24N4O5S/c1-29-18-11-17(12-19(13-18)30-2)23-21(26)15-24-7-9-25(10-8-24)31(27,28)20-6-4-3-5-16(20)14-22/h3-6,11-13H,7-10,15H2,1-2H3,(H,23,26)