4-bromanyl-1-butyl-5-methyl-pyrazol-3-amine

Systemtic Name: 4-bromanyl-1-butyl-5-methyl-pyrazol-3-amine Openeye Name: 4-bromo-1-butyl-5-methyl-pyrazol-3-amine CAS Name: 4-bromo-1-butyl-5-methyl-3-pyrazolamine IUPAC Name: 4-bromo-1-butyl-5-methylpyrazol-3-amine Traditional Name: (4-bromo-1-butyl-5-methyl-pyrazol-3-yl)amine Formula: C8H14BrN3 MolecularWeight: 232.12086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)N)Br)C

Isomeric SMILES

CCCCN1C(=C(C(=N1)N)Br)C

InChI

InChI=1S/C8H14BrN3/c1-3-4-5-12-6(2)7(9)8(10)11-12/h3-5H2,1-2H3,(H2,10,11)