4-[2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-[[2-(2-bromoanilino)-2-oxo-ethyl]-methyl-amino]acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[[2-(2-bromoanilino)-2-keto-ethyl]-methyl-amino]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C22H26BrN5O3 MolecularWeight: 488.37754

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)CC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)CC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26BrN5O3/c1-26(15-20(29)25-19-10-6-5-9-18(19)23)16-21(30)27-11-13-28(14-12-27)22(31)24-17-7-3-2-4-8-17/h2-10H,11-16H2,1H3,(H,24,31)(H,25,29)