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

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(2-sulfanylethyl)butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(2-sulfanylethyl)butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-(2-mercaptoethyl)butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(2-sulfanylethyl)butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(2-mercaptoethyl)butyramide Formula: C9H14BrN3OS MolecularWeight: 292.19596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14BrN3OS/c1-2-8(9(14)11-3-4-15)13-6-7(10)5-12-13/h5-6,8,15H,2-4H2,1H3,(H,11,14)