5-bromanyl-N-[(E)-(4-fluorophenyl)methylideneamino]-2-[[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]phenyl]carbonylamino]benzamide

Systemtic Name: 5-bromanyl-N-[(E)-(4-fluorophenyl)methylideneamino]-2-[[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]phenyl]carbonylamino]benzamide Openeye Name: 5-bromo-N-[(E)-(4-fluorophenyl)methyleneamino]-2-[[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzoyl]amino]benzamide CAS Name: 5-bromo-N-[(E)-(4-fluorophenyl)methylideneamino]-2-[[[4-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]phenyl]-oxomethyl]amino]benzamide IUPAC Name: 5-bromo-N-[(E)-(4-fluorophenyl)methylideneamino]-2-[[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzoyl]amino]benzamide Traditional Name: 5-bromo-N-[(E)-(4-fluorobenzylidene)amino]-2-[[4-[[4-(2-hydroxyethyl)piperazino]methyl]benzoyl]amino]benzamide Formula: C28H29BrFN5O3 MolecularWeight: 582.463963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)CC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)NN=CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCO)CC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)N/N=C/C4=CC=C(C=C4)F

InChI

InChI=1S/C28H29BrFN5O3/c29-23-7-10-26(25(17-23)28(38)33-31-18-20-3-8-24(30)9-4-20)32-27(37)22-5-1-21(2-6-22)19-35-13-11-34(12-14-35)15-16-36/h1-10,17-18,36H,11-16,19H2,(H,32,37)(H,33,38)/b31-18+