(3S)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-propan-2-yl-piperazin-2-one

Systemtic Name: (3S)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-propan-2-yl-piperazin-2-one Openeye Name: (3S)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-isopropyl-piperazin-2-one CAS Name: (3S)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-propan-2-yl-2-piperazinone IUPAC Name: (3S)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-propan-2-ylpiperazin-2-one Traditional Name: (3S)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-isopropyl-piperazin-2-one Formula: C18H24N4O MolecularWeight: 312.40936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3C(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)[C@H]3C(=O)NCCN3C(C)C

InChI

InChI=1S/C18H24N4O/c1-12(2)21-11-10-19-18(23)17(21)16-13(3)20-22(14(16)4)15-8-6-5-7-9-15/h5-9,12,17H,10-11H2,1-4H3,(H,19,23)/t17-/m0/s1