N-(3,4-dimethoxyphenyl)-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 1,4-bis(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)piperazine-2-carboxamide CAS Name: 1,4-bis(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)-2-piperazinecarboxamide IUPAC Name: 1,4-bis(benzenesulfonyl)-N-(3,4-dimethoxyphenyl)piperazine-2-carboxamide Traditional Name: 1,4-dibesyl-N-(3,4-dimethoxyphenyl)piperazine-2-carboxamide Formula: C25H27N3O7S2 MolecularWeight: 545.62778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CN(CCN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CN(CCN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H27N3O7S2/c1-34-23-14-13-19(17-24(23)35-2)26-25(29)22-18-27(36(30,31)20-9-5-3-6-10-20)15-16-28(22)37(32,33)21-11-7-4-8-12-21/h3-14,17,22H,15-16,18H2,1-2H3,(H,26,29)