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

Systemtic Name: (2S)-N-(3-methylphenyl)-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: (2S)-1,4-bis(benzenesulfonyl)-N-(m-tolyl)piperazine-2-carboxamide CAS Name: (2S)-1,4-bis(benzenesulfonyl)-N-(3-methylphenyl)-2-piperazinecarboxamide IUPAC Name: (2S)-1,4-bis(benzenesulfonyl)-N-(3-methylphenyl)piperazine-2-carboxamide Traditional Name: (2S)-1,4-dibesyl-N-(m-tolyl)piperazine-2-carboxamide Formula: C24H25N3O5S2 MolecularWeight: 499.6024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O5S2/c1-19-9-8-10-20(17-19)25-24(28)23-18-26(33(29,30)21-11-4-2-5-12-21)15-16-27(23)34(31,32)22-13-6-3-7-14-22/h2-14,17,23H,15-16,18H2,1H3,(H,25,28)/t23-/m0/s1