(E)-but-2-enedioic acid; 4-chloranyl-2-[3-[[2-methyl-1-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]amino]propan-2-yl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: (E)-but-2-enedioic acid; 4-chloranyl-2-[3-[[2-methyl-1-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]amino]propan-2-yl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[3-[[1,1-dimethyl-2-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]ethyl]amino]-2-hydroxy-propoxy]benzonitrile; fumaric acid CAS Name: (E)-2-butenedioic acid; 4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile IUPAC Name: (E)-but-2-enedioic acid; 4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile Traditional Name: 4-chloro-2-[2-hydroxy-3-[[2-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)anilino]-1,1-dimethyl-ethyl]amino]propoxy]benzonitrile; fumaric acid Formula: C29H34ClN5O7 MolecularWeight: 600.06256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)NCC(C)(C)NCC(COC3=C(C=CC(=C3)Cl)C#N)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)NCC(C)(C)NCC(COC3=C(C=CC(=C3)Cl)C#N)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C25H30ClN5O3.C4H4O4/c1-16-10-23(33)30-31-24(16)17-5-8-20(9-6-17)28-15-25(2,3)29-13-21(32)14-34-22-11-19(26)7-4-18(22)12-27;5-3(6)1-2-4(7)8/h4-9,11,16,21,28-29,32H,10,13-15H2,1-3H3,(H,30,33);1-2H,(H,5,6)(H,7,8)/b;2-1+