5-(4-bromophenyl)-N3-(phenylmethyl)-1H-pyrazole-3,4-diamine

Systemtic Name: 5-(4-bromophenyl)-N3-(phenylmethyl)-1H-pyrazole-3,4-diamine Openeye Name: N3-benzyl-5-(4-bromophenyl)-1H-pyrazole-3,4-diamine CAS Name: 5-(4-bromophenyl)-N3-(phenylmethyl)-1H-pyrazole-3,4-diamine IUPAC Name: 3-N-benzyl-5-(4-bromophenyl)-1H-pyrazole-3,4-diamine Traditional Name: [4-amino-5-(4-bromophenyl)-1H-pyrazol-3-yl]-benzyl-amine Formula: C16H15BrN4 MolecularWeight: 343.2211

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NNC(=C2N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NNC(=C2N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H15BrN4/c17-13-8-6-12(7-9-13)15-14(18)16(21-20-15)19-10-11-4-2-1-3-5-11/h1-9H,10,18H2,(H2,19,20,21)