2-(4-bromanylpyrazol-1-yl)-N-(2-sulfanylethyl)propanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(2-sulfanylethyl)propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-(2-mercaptoethyl)propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(2-mercaptoethyl)propionamide Formula: C8H12BrN3OS MolecularWeight: 278.16938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCS)N1C=C(C=N1)Br

Isomeric SMILES

CC(C(=O)NCCS)N1C=C(C=N1)Br

InChI

InChI=1S/C8H12BrN3OS/c1-6(8(13)10-2-3-14)12-5-7(9)4-11-12/h4-6,14H,2-3H2,1H3,(H,10,13)