5-methyl-4-[[1-[3-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-2-oxidanyl-propyl]indol-3-yl]methylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: 5-methyl-4-[[1-[3-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-2-oxidanyl-propyl]indol-3-yl]methylidene]-2-phenyl-pyrazol-3-one Openeye Name: 4-[[1-[2-hydroxy-3-[(2-hydroxy-1,1-dimethyl-ethyl)amino]propyl]indol-3-yl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[1-[2-hydroxy-3-[(1-hydroxy-2-methylpropan-2-yl)amino]propyl]-3-indolyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[1-[2-hydroxy-3-[(1-hydroxy-2-methylpropan-2-yl)amino]propyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[[1-[2-hydroxy-3-[(2-hydroxy-1,1-dimethyl-ethyl)amino]propyl]indol-3-yl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNC(C)(C)CO)O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNC(C)(C)CO)O)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3/c1-18-23(25(33)30(28-18)20-9-5-4-6-10-20)13-19-15-29(24-12-8-7-11-22(19)24)16-21(32)14-27-26(2,3)17-31/h4-13,15,21,27,31-32H,14,16-17H2,1-3H3