N-[(E)-(3-bromophenyl)methylideneamino]-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: N-[(E)-(3-bromophenyl)methylideneamino]-1,4-bis(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 1,4-bis(benzenesulfonyl)-N-[(E)-(3-bromophenyl)methyleneamino]piperazine-2-carboxamide CAS Name: 1,4-bis(benzenesulfonyl)-N-[(E)-(3-bromophenyl)methylideneamino]-2-piperazinecarboxamide IUPAC Name: 1,4-bis(benzenesulfonyl)-N-[(E)-(3-bromophenyl)methylideneamino]piperazine-2-carboxamide Traditional Name: 1,4-dibesyl-N-[(E)-(3-bromobenzylidene)amino]piperazine-2-carboxamide Formula: C24H23BrN4O5S2 MolecularWeight: 591.49722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1S(=O)(=O)C2=CC=CC=C2)C(=O)NN=CC3=CC(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(CN1S(=O)(=O)C2=CC=CC=C2)C(=O)N/N=C/C3=CC(=CC=C3)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H23BrN4O5S2/c25-20-9-7-8-19(16-20)17-26-27-24(30)23-18-28(35(31,32)21-10-3-1-4-11-21)14-15-29(23)36(33,34)22-12-5-2-6-13-22/h1-13,16-17,23H,14-15,18H2,(H,27,30)/b26-17+