4-bromanyl-3-methyl-N-[(1-methylpyrazol-4-yl)methyl]aniline

Systemtic Name: 4-bromanyl-3-methyl-N-[(1-methylpyrazol-4-yl)methyl]aniline Openeye Name: 4-bromo-3-methyl-N-[(1-methylpyrazol-4-yl)methyl]aniline CAS Name: 4-bromo-3-methyl-N-[(1-methyl-4-pyrazolyl)methyl]aniline IUPAC Name: 4-bromo-3-methyl-N-[(1-methylpyrazol-4-yl)methyl]aniline Traditional Name: (4-bromo-3-methyl-phenyl)-[(1-methylpyrazol-4-yl)methyl]amine Formula: C12H14BrN3 MolecularWeight: 280.16366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCC2=CN(N=C2)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NCC2=CN(N=C2)C)Br

InChI

InChI=1S/C12H14BrN3/c1-9-5-11(3-4-12(9)13)14-6-10-7-15-16(2)8-10/h3-5,7-8,14H,6H2,1-2H3