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

Systemtic Name: (2S)-N-(3,4-dimethylphenyl)-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: (2S)-1,4-bis(benzenesulfonyl)-N-(3,4-dimethylphenyl)piperazine-2-carboxamide CAS Name: (2S)-1,4-bis(benzenesulfonyl)-N-(3,4-dimethylphenyl)-2-piperazinecarboxamide IUPAC Name: (2S)-1,4-bis(benzenesulfonyl)-N-(3,4-dimethylphenyl)piperazine-2-carboxamide Traditional Name: (2S)-1,4-dibesyl-N-(3,4-dimethylphenyl)piperazine-2-carboxamide Formula: C25H27N3O5S2 MolecularWeight: 513.62898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@@H]2CN(CCN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H27N3O5S2/c1-19-13-14-21(17-20(19)2)26-25(29)24-18-27(34(30,31)22-9-5-3-6-10-22)15-16-28(24)35(32,33)23-11-7-4-8-12-23/h3-14,17,24H,15-16,18H2,1-2H3,(H,26,29)/t24-/m0/s1