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

Systemtic Name: N-[(E)-(4-methylphenyl)methylideneamino]-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 1,4-bis(benzenesulfonyl)-N-[(E)-p-tolylmethyleneamino]piperazine-2-carboxamide CAS Name: 1,4-bis(benzenesulfonyl)-N-[(E)-(4-methylphenyl)methylideneamino]-2-piperazinecarboxamide IUPAC Name: 1,4-bis(benzenesulfonyl)-N-[(E)-(4-methylphenyl)methylideneamino]piperazine-2-carboxamide Traditional Name: 1,4-dibesyl-N-[(E)-(4-methylbenzylidene)amino]piperazine-2-carboxamide Formula: C25H26N4O5S2 MolecularWeight: 526.62774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O5S2/c1-20-12-14-21(15-13-20)18-26-27-25(30)24-19-28(35(31,32)22-8-4-2-5-9-22)16-17-29(24)36(33,34)23-10-6-3-7-11-23/h2-15,18,24H,16-17,19H2,1H3,(H,27,30)/b26-18+