5-bromanyl-N-[(E)-(3-methylphenyl)methylideneamino]-2-[[4-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]methyl]phenyl]carbonylamino]benzamide

Systemtic Name: 5-bromanyl-N-[(E)-(3-methylphenyl)methylideneamino]-2-[[4-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]methyl]phenyl]carbonylamino]benzamide Openeye Name: 5-bromo-2-[[4-[[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]methyl]benzoyl]amino]-N-[(E)-m-tolylmethyleneamino]benzamide CAS Name: 5-bromo-N-[(E)-(3-methylphenyl)methylideneamino]-2-[[[4-[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]methyl]phenyl]-oxomethyl]amino]benzamide IUPAC Name: 5-bromo-N-[(E)-(3-methylphenyl)methylideneamino]-2-[[4-[[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]methyl]benzoyl]amino]benzamide Traditional Name: 5-bromo-2-[[4-[[4-(2-keto-2-morpholino-ethyl)piperazino]methyl]benzoyl]amino]-N-[(E)-(3-methylbenzylidene)amino]benzamide Formula: C33H37BrN6O4 MolecularWeight: 661.58868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=NNC(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)CC(=O)N5CCOCC5

Isomeric SMILES

CC1=CC=CC(=C1)/C=N/NC(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)CC(=O)N5CCOCC5

InChI

InChI=1S/C33H37BrN6O4/c1-24-3-2-4-26(19-24)21-35-37-33(43)29-20-28(34)9-10-30(29)36-32(42)27-7-5-25(6-8-27)22-38-11-13-39(14-12-38)23-31(41)40-15-17-44-18-16-40/h2-10,19-21H,11-18,22-23H2,1H3,(H,36,42)(H,37,43)/b35-21+