2-(4-ethylphenyl)-5-(1H-imidazol-2-ylmethyl)-4-methyl-4H-pyrazol-3-one

Systemtic Name: 2-(4-ethylphenyl)-5-(1H-imidazol-2-ylmethyl)-4-methyl-4H-pyrazol-3-one Openeye Name: 2-(4-ethylphenyl)-5-(1H-imidazol-2-ylmethyl)-4-methyl-4H-pyrazol-3-one CAS Name: 2-(4-ethylphenyl)-5-(1H-imidazol-2-ylmethyl)-4-methyl-4H-pyrazol-3-one IUPAC Name: 2-(4-ethylphenyl)-5-(1H-imidazol-2-ylmethyl)-4-methyl-4H-pyrazol-3-one Traditional Name: 2-(4-ethylphenyl)-5-(1H-imidazol-2-ylmethyl)-4-methyl-2-pyrazolin-3-one Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(C(=N2)CC3=NC=CN3)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(C(=N2)CC3=NC=CN3)C

InChI

InChI=1S/C16H18N4O/c1-3-12-4-6-13(7-5-12)20-16(21)11(2)14(19-20)10-15-17-8-9-18-15/h4-9,11H,3,10H2,1-2H3,(H,17,18)