3-azanyl-4-(4-methylphenyl)-2-(phenylmethyl)-1H-pyrazol-5-one

Systemtic Name: 3-azanyl-4-(4-methylphenyl)-2-(phenylmethyl)-1H-pyrazol-5-one Openeye Name: 3-amino-2-benzyl-4-(p-tolyl)-1H-pyrazol-5-one CAS Name: 3-amino-4-(4-methylphenyl)-2-(phenylmethyl)-1H-pyrazol-5-one IUPAC Name: 3-amino-2-benzyl-4-(4-methylphenyl)-1H-pyrazol-5-one Traditional Name: 5-amino-1-benzyl-4-(p-tolyl)-3-pyrazolin-3-one Formula: C17H17N3O MolecularWeight: 279.33638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(NC2=O)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(NC2=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C17H17N3O/c1-12-7-9-14(10-8-12)15-16(18)20(19-17(15)21)11-13-5-3-2-4-6-13/h2-10H,11,18H2,1H3,(H,19,21)