2-(4-bromophenyl)-1-(1-methylpyrazol-4-yl)ethanamine

Systemtic Name: 2-(4-bromophenyl)-1-(1-methylpyrazol-4-yl)ethanamine Openeye Name: 2-(4-bromophenyl)-1-(1-methylpyrazol-4-yl)ethanamine CAS Name: 2-(4-bromophenyl)-1-(1-methyl-4-pyrazolyl)ethanamine IUPAC Name: 2-(4-bromophenyl)-1-(1-methylpyrazol-4-yl)ethanamine Traditional Name: [2-(4-bromophenyl)-1-(1-methylpyrazol-4-yl)ethyl]amine Formula: C12H14BrN3 MolecularWeight: 280.16366

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(CC2=CC=C(C=C2)Br)N

Isomeric SMILES

CN1C=C(C=N1)C(CC2=CC=C(C=C2)Br)N

InChI

InChI=1S/C12H14BrN3/c1-16-8-10(7-15-16)12(14)6-9-2-4-11(13)5-3-9/h2-5,7-8,12H,6,14H2,1H3