3-(4-bromanylpyrazol-1-yl)-N-(2-sulfanylethyl)propanamide

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-N-(2-sulfanylethyl)propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-(2-mercaptoethyl)propanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-N-(2-mercaptoethyl)propionamide Formula: C8H12BrN3OS MolecularWeight: 278.16938

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CCC(=O)NCCS)Br

Isomeric SMILES

C1=C(C=NN1CCC(=O)NCCS)Br

InChI

InChI=1S/C8H12BrN3OS/c9-7-5-11-12(6-7)3-1-8(13)10-2-4-14/h5-6,14H,1-4H2,(H,10,13)