4-azanyl-1-methyl-2-(phenylmethyl)-5-propan-2-yl-pyrazol-3-one

Systemtic Name: 4-azanyl-1-methyl-2-(phenylmethyl)-5-propan-2-yl-pyrazol-3-one Openeye Name: 4-amino-2-benzyl-5-isopropyl-1-methyl-pyrazol-3-one CAS Name: 4-amino-1-methyl-2-(phenylmethyl)-5-propan-2-yl-3-pyrazolone IUPAC Name: 4-amino-2-benzyl-1-methyl-5-propan-2-ylpyrazol-3-one Traditional Name: 4-amino-2-benzyl-5-isopropyl-1-methyl-3-pyrazolin-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)N(N1C)CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C1=C(C(=O)N(N1C)CC2=CC=CC=C2)N

InChI

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