(2S)-2-(4-bromanylpyrazol-1-yl)-N-propyl-propanamide

Systemtic Name: (2S)-2-(4-bromanylpyrazol-1-yl)-N-propyl-propanamide Openeye Name: (2S)-2-(4-bromopyrazol-1-yl)-N-propyl-propanamide CAS Name: (2S)-2-(4-bromo-1-pyrazolyl)-N-propylpropanamide IUPAC Name: (2S)-2-(4-bromopyrazol-1-yl)-N-propylpropanamide Traditional Name: (2S)-2-(4-bromopyrazol-1-yl)-N-propyl-propionamide Formula: C9H14BrN3O MolecularWeight: 260.13096

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)N1C=C(C=N1)Br

Isomeric SMILES

CCCNC(=O)[C@H](C)N1C=C(C=N1)Br

InChI

InChI=1S/C9H14BrN3O/c1-3-4-11-9(14)7(2)13-6-8(10)5-12-13/h5-7H,3-4H2,1-2H3,(H,11,14)/t7-/m0/s1