5-azanyl-4-methyl-2-(1-phenylbutan-2-yl)-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-4-methyl-2-(1-phenylbutan-2-yl)-1H-pyrazol-3-one Openeye Name: 5-amino-2-(1-benzylpropyl)-4-methyl-1H-pyrazol-3-one CAS Name: 5-amino-4-methyl-2-(1-phenylbutan-2-yl)-1H-pyrazol-3-one IUPAC Name: 5-amino-4-methyl-2-(1-phenylbutan-2-yl)-1H-pyrazol-3-one Traditional Name: 5-amino-2-(1-benzylpropyl)-4-methyl-3-pyrazolin-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)N2C(=O)C(=C(N2)N)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)N2C(=O)C(=C(N2)N)C

InChI

InChI=1S/C14H19N3O/c1-3-12(9-11-7-5-4-6-8-11)17-14(18)10(2)13(15)16-17/h4-8,12,16H,3,9,15H2,1-2H3