4-bromanyl-2-(4-butylphenyl)-5-methyl-pyrazol-3-amine

Systemtic Name: 4-bromanyl-2-(4-butylphenyl)-5-methyl-pyrazol-3-amine Openeye Name: 4-bromo-2-(4-butylphenyl)-5-methyl-pyrazol-3-amine CAS Name: 4-bromo-2-(4-butylphenyl)-5-methyl-3-pyrazolamine IUPAC Name: 4-bromo-2-(4-butylphenyl)-5-methylpyrazol-3-amine Traditional Name: [4-bromo-2-(4-butylphenyl)-5-methyl-pyrazol-3-yl]amine Formula: C14H18BrN3 MolecularWeight: 308.21682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=C(C(=N2)C)Br)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=C(C(=N2)C)Br)N

InChI

InChI=1S/C14H18BrN3/c1-3-4-5-11-6-8-12(9-7-11)18-14(16)13(15)10(2)17-18/h6-9H,3-5,16H2,1-2H3