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

Systemtic Name: 2-(4-butoxyphenyl)-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one Openeye Name: 2-(4-butoxyphenyl)-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one CAS Name: 2-(4-butoxyphenyl)-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one IUPAC Name: 2-(4-butoxyphenyl)-5-(1H-imidazol-2-ylmethyl)-4H-pyrazol-3-one Traditional Name: 2-(4-butoxyphenyl)-5-(1H-imidazol-2-ylmethyl)-2-pyrazolin-3-one Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=O)CC(=N2)CC3=NC=CN3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=O)CC(=N2)CC3=NC=CN3

InChI

InChI=1S/C17H20N4O2/c1-2-3-10-23-15-6-4-14(5-7-15)21-17(22)12-13(20-21)11-16-18-8-9-19-16/h4-9H,2-3,10-12H2,1H3,(H,18,19)