(3S)-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one

Systemtic Name: (3S)-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one Openeye Name: (3S)-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one CAS Name: (3S)-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-1,3-dimethyl-2-piperazinone IUPAC Name: (3S)-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-1,3-dimethylpiperazin-2-one Traditional Name: (3S)-4-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-1,3-dimethyl-piperazin-2-one Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCN1CC2=C(NN=C2)C3=C(C=C(C=C3)OC)OC)C

Isomeric SMILES

C[C@H]1C(=O)N(CCN1CC2=C(NN=C2)C3=C(C=C(C=C3)OC)OC)C

InChI

InChI=1S/C18H24N4O3/c1-12-18(23)21(2)7-8-22(12)11-13-10-19-20-17(13)15-6-5-14(24-3)9-16(15)25-4/h5-6,9-10,12H,7-8,11H2,1-4H3,(H,19,20)/t12-/m0/s1