(4E)-5-methyl-2-phenyl-4-[[1-(phenylmethyl)indol-3-yl]methylidene]pyrazol-3-one

Systemtic Name: (4E)-5-methyl-2-phenyl-4-[[1-(phenylmethyl)indol-3-yl]methylidene]pyrazol-3-one Openeye Name: (4E)-4-[(1-benzylindol-3-yl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-5-methyl-2-phenyl-4-[[1-(phenylmethyl)-3-indolyl]methylidene]-3-pyrazolone IUPAC Name: (4E)-4-[(1-benzylindol-3-yl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[(1-benzylindol-3-yl)methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C26H21N3O MolecularWeight: 391.46444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O/c1-19-24(26(30)29(27-19)22-12-6-3-7-13-22)16-21-18-28(17-20-10-4-2-5-11-20)25-15-9-8-14-23(21)25/h2-16,18H,17H2,1H3/b24-16+