4-bromanyl-2,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-N-(2-mercaptoethyl)-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-N-(2-mercaptoethyl)-2,5-dimethyl-pyrazole-3-carboxamide Formula: C8H12BrN3OS MolecularWeight: 278.16938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C(=O)NCCS)C

Isomeric SMILES

CC1=NN(C(=C1Br)C(=O)NCCS)C

InChI

InChI=1S/C8H12BrN3OS/c1-5-6(9)7(12(2)11-5)8(13)10-3-4-14/h14H,3-4H2,1-2H3,(H,10,13)