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

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(2S)-butan-2-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(1S)-1-methylpropyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-[(2S)-butan-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[(2S)-butan-2-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(1S)-1-methylpropyl]pyrazole-3-carboxamide Formula: C14H20BrN5O MolecularWeight: 354.2455

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=NN(C=C1)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CC[C@H](C)NC(=O)C1=NN(C=C1)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C14H20BrN5O/c1-5-9(2)16-14(21)12-6-7-19(18-12)8-20-11(4)13(15)10(3)17-20/h6-7,9H,5,8H2,1-4H3,(H,16,21)/t9-/m0/s1