(4Z)-4-[(1H-benzimidazol-2-ylmethylamino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[(1H-benzimidazol-2-ylmethylamino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one Openeye Name: (4Z)-4-[(1H-benzimidazol-2-ylmethylamino)methylene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one CAS Name: (4Z)-4-[(1H-benzimidazol-2-ylmethylamino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-3-pyrazolone IUPAC Name: (4Z)-4-[(1H-benzimidazol-2-ylmethylamino)methylidene]-2-(3,4-dimethylphenyl)-5-methylpyrazol-3-one Traditional Name: (4Z)-4-[(1H-benzimidazol-2-ylmethylamino)methylene]-2-(3,4-dimethylphenyl)-5-methyl-2-pyrazolin-3-one Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNCC3=NC4=CC=CC=C4N3)C(=N2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C\NCC3=NC4=CC=CC=C4N3)/C(=N2)C)C

InChI

InChI=1S/C21H21N5O/c1-13-8-9-16(10-14(13)2)26-21(27)17(15(3)25-26)11-22-12-20-23-18-6-4-5-7-19(18)24-20/h4-11,22H,12H2,1-3H3,(H,23,24)/b17-11-