2-(4-butylphenyl)-4-ethyl-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one

Systemtic Name: 2-(4-butylphenyl)-4-ethyl-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one Openeye Name: 2-(4-butylphenyl)-4-ethyl-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one CAS Name: 2-(4-butylphenyl)-4-ethyl-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one IUPAC Name: 2-(4-butylphenyl)-4-ethyl-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one Traditional Name: 2-(4-butylphenyl)-4-ethyl-5-(1H-imidazol-2-ylmethyl)-2-pyrazolin-3-one Formula: C19H24N4O MolecularWeight: 324.42006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(C(=N2)CC3=NC=CN3)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(C(=N2)CC3=NC=CN3)CC

InChI

InChI=1S/C19H24N4O/c1-3-5-6-14-7-9-15(10-8-14)23-19(24)16(4-2)17(22-23)13-18-20-11-12-21-18/h7-12,16H,3-6,13H2,1-2H3,(H,20,21)