3,5-dimethoxy-N-[2-[4-(phenylmethyl)piperazin-1-yl]sulfonylethyl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[2-[4-(phenylmethyl)piperazin-1-yl]sulfonylethyl]benzamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)sulfonylethyl]-3,5-dimethoxy-benzamide CAS Name: 3,5-dimethoxy-N-[2-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)sulfonylethyl]-3,5-dimethoxybenzamide Traditional Name: N-[2-(4-benzylpiperazino)sulfonylethyl]-3,5-dimethoxy-benzamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H29N3O5S/c1-29-20-14-19(15-21(16-20)30-2)22(26)23-8-13-31(27,28)25-11-9-24(10-12-25)17-18-6-4-3-5-7-18/h3-7,14-16H,8-13,17H2,1-2H3,(H,23,26)