(4Z)-5-methyl-4-[(3-methyl-1-phenyl-6-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridin-5-yl)methylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-4-[(3-methyl-1-phenyl-6-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridin-5-yl)methylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-5-methyl-4-[(3-methyl-1-phenyl-6-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridin-5-yl)methylene]-2-phenyl-pyrazol-3-one CAS Name: (4Z)-5-methyl-4-[[3-methyl-1-phenyl-6-(1-pyrrolidinyl)-5-pyrazolo[3,4-b]pyridinyl]methylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-5-methyl-4-[(3-methyl-1-phenyl-6-pyrrolidin-1-ylpyrazolo[3,4-b]pyridin-5-yl)methylidene]-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-methyl-4-[(3-methyl-1-phenyl-6-pyrrolidino-pyrazolo[3,4-b]pyridin-5-yl)methylene]-2-phenyl-2-pyrazolin-3-one Formula: C28H26N6O MolecularWeight: 462.54564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=C(C=C12)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)N5CCCC5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=NC(=C(C=C12)/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)C)N5CCCC5)C6=CC=CC=C6

InChI

InChI=1S/C28H26N6O/c1-19-24-17-21(18-25-20(2)31-34(28(25)35)23-13-7-4-8-14-23)26(32-15-9-10-16-32)29-27(24)33(30-19)22-11-5-3-6-12-22/h3-8,11-14,17-18H,9-10,15-16H2,1-2H3/b25-18-