N-(phenylmethyl)pyrazol-1-amine; 2,4,6-tris(bromanyl)aniline

Systemtic Name: N-(phenylmethyl)pyrazol-1-amine; 2,4,6-tris(bromanyl)aniline Openeye Name: N-benzylpyrazol-1-amine; 2,4,6-tribromoaniline CAS Name: N-(phenylmethyl)-1-pyrazolamine; 2,4,6-tribromoaniline IUPAC Name: N-benzylpyrazol-1-amine; 2,4,6-tribromoaniline Traditional Name: benzyl(pyrazol-1-yl)amine; (2,4,6-tribromophenyl)amine Formula: C16H15Br3N4 MolecularWeight: 503.0291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNN2C=CC=N2.C1=C(C=C(C(=C1Br)N)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)CNN2C=CC=N2.C1=C(C=C(C(=C1Br)N)Br)Br

InChI

InChI=1S/C10H11N3.C6H4Br3N/c1-2-5-10(6-3-1)9-12-13-8-4-7-11-13;7-3-1-4(8)6(10)5(9)2-3/h1-8,12H,9H2;1-2H,10H2