2-[3-[(4-bromophenyl)methyl-pyrimidin-2-yl-amino]propyl]-1-[3-(1H-imidazol-5-yl)propyl]guanidine

Systemtic Name: 2-[3-[(4-bromophenyl)methyl-pyrimidin-2-yl-amino]propyl]-1-[3-(1H-imidazol-5-yl)propyl]guanidine Openeye Name: 2-[3-[(4-bromophenyl)methyl-pyrimidin-2-yl-amino]propyl]-1-[3-(1H-imidazol-5-yl)propyl]guanidine CAS Name: 2-[3-[(4-bromophenyl)methyl-(2-pyrimidinyl)amino]propyl]-1-[3-(1H-imidazol-5-yl)propyl]guanidine IUPAC Name: 2-[3-[(4-bromophenyl)methyl-pyrimidin-2-ylamino]propyl]-1-[3-(1H-imidazol-5-yl)propyl]guanidine Traditional Name: 2-[3-[(4-bromobenzyl)-(2-pyrimidyl)amino]propyl]-1-[3-(1H-imidazol-5-yl)propyl]guanidine Formula: C21H27BrN8 MolecularWeight: 471.39668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)N(CCCN=C(N)NCCCC2=CN=CN2)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CN=C(N=C1)N(CCCN=C(N)NCCCC2=CN=CN2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H27BrN8/c22-18-7-5-17(6-8-18)15-30(21-27-10-2-11-28-21)13-3-12-26-20(23)25-9-1-4-19-14-24-16-29-19/h2,5-8,10-11,14,16H,1,3-4,9,12-13,15H2,(H,24,29)(H3,23,25,26)