2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[(2S)-butan-2-yl]ethanamide

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[(2S)-butan-2-yl]ethanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[(1S)-1-methylpropyl]acetamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[(2S)-butan-2-yl]acetamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[(2S)-butan-2-yl]acetamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[(1S)-1-methylpropyl]acetamide Formula: C11H18BrN3O MolecularWeight: 288.18412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1C(=C(C(=N1)C)Br)C

Isomeric SMILES

CC[C@H](C)NC(=O)CN1C(=C(C(=N1)C)Br)C

InChI

InChI=1S/C11H18BrN3O/c1-5-7(2)13-10(16)6-15-9(4)11(12)8(3)14-15/h7H,5-6H2,1-4H3,(H,13,16)/t7-/m0/s1