2-bromanyl-4,6-bis(fluoranyl)aniline; 2-(phenylmethyl)pyrazol-3-amine

Systemtic Name: 2-bromanyl-4,6-bis(fluoranyl)aniline; 2-(phenylmethyl)pyrazol-3-amine Openeye Name: 2-benzylpyrazol-3-amine; 2-bromo-4,6-difluoro-aniline CAS Name: 2-bromo-4,6-difluoroaniline; 2-(phenylmethyl)-3-pyrazolamine IUPAC Name: 2-benzylpyrazol-3-amine; 2-bromo-4,6-difluoroaniline Traditional Name: (2-benzylpyrazol-3-yl)amine; (2-bromo-4,6-difluoro-phenyl)amine Formula: C16H15BrF2N4 MolecularWeight: 381.217906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)N.C1=C(C=C(C(=C1F)N)Br)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)N.C1=C(C=C(C(=C1F)N)Br)F

InChI

InChI=1S/C10H11N3.C6H4BrF2N/c11-10-6-7-12-13(10)8-9-4-2-1-3-5-9;7-4-1-3(8)2-5(9)6(4)10/h1-7H,8,11H2;1-2H,10H2