(2S)-2-(4-bromanylpyrazol-1-yl)-1-[(2S)-2-methylpiperidin-1-yl]propan-1-one

Systemtic Name: (2S)-2-(4-bromanylpyrazol-1-yl)-1-[(2S)-2-methylpiperidin-1-yl]propan-1-one Openeye Name: (2S)-2-(4-bromopyrazol-1-yl)-1-[(2S)-2-methyl-1-piperidyl]propan-1-one CAS Name: (2S)-2-(4-bromo-1-pyrazolyl)-1-[(2S)-2-methyl-1-piperidinyl]-1-propanone IUPAC Name: (2S)-2-(4-bromopyrazol-1-yl)-1-[(2S)-2-methylpiperidin-1-yl]propan-1-one Traditional Name: (2S)-2-(4-bromopyrazol-1-yl)-1-[(2S)-2-methylpiperidino]propan-1-one Formula: C12H18BrN3O MolecularWeight: 300.19482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C(C)N2C=C(C=N2)Br

Isomeric SMILES

C[C@H]1CCCCN1C(=O)[C@H](C)N2C=C(C=N2)Br

InChI

InChI=1S/C12H18BrN3O/c1-9-5-3-4-6-15(9)12(17)10(2)16-8-11(13)7-14-16/h7-10H,3-6H2,1-2H3/t9-,10-/m0/s1