2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1-[(3S)-3-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-1-[(3S)-3-methylpiperidin-1-yl]ethanone Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-1-[(3S)-3-methyl-1-piperidyl]ethanone CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-[(3S)-3-methyl-1-piperidinyl]ethanone IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-1-[(3S)-3-methylpiperidin-1-yl]ethanone Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-1-[(3S)-3-methylpiperidino]ethanone Formula: C13H20BrN3O MolecularWeight: 314.2214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C13H20BrN3O/c1-9-5-4-6-16(7-9)12(18)8-17-11(3)13(14)10(2)15-17/h9H,4-8H2,1-3H3/t9-/m0/s1