N-[(4-methylphenyl)methyl]-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 1,4-bis(benzenesulfonyl)-N-(p-tolylmethyl)piperazine-2-carboxamide CAS Name: 1,4-bis(benzenesulfonyl)-N-[(4-methylphenyl)methyl]-2-piperazinecarboxamide IUPAC Name: 1,4-bis(benzenesulfonyl)-N-[(4-methylphenyl)methyl]piperazine-2-carboxamide Traditional Name: 1,4-dibesyl-N-(4-methylbenzyl)piperazine-2-carboxamide Formula: C25H27N3O5S2 MolecularWeight: 513.62898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CN(CCN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CN(CCN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O5S2/c1-20-12-14-21(15-13-20)18-26-25(29)24-19-27(34(30,31)22-8-4-2-5-9-22)16-17-28(24)35(32,33)23-10-6-3-7-11-23/h2-15,24H,16-19H2,1H3,(H,26,29)