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

Systemtic Name: 1-[3-(4-bromophenyl)-3-pyridin-2-yl-propyl]-3-[3-(1H-imidazol-5-yl)propyl]-2-methyl-guanidine Openeye Name: 1-[3-(4-bromophenyl)-3-(2-pyridyl)propyl]-3-[3-(1H-imidazol-5-yl)propyl]-2-methyl-guanidine CAS Name: 1-[3-(4-bromophenyl)-3-(2-pyridinyl)propyl]-3-[3-(1H-imidazol-5-yl)propyl]-2-methylguanidine IUPAC Name: 1-[3-(4-bromophenyl)-3-pyridin-2-ylpropyl]-3-[3-(1H-imidazol-5-yl)propyl]-2-methylguanidine Traditional Name: 1-[3-(4-bromophenyl)-3-(2-pyridyl)propyl]-3-[3-(1H-imidazol-5-yl)propyl]-2-methyl-guanidine Formula: C22H27BrN6 MolecularWeight: 455.39398

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCCC1=CN=CN1)NCCC(C2=CC=C(C=C2)Br)C3=CC=CC=N3

Isomeric SMILES

CN=C(NCCCC1=CN=CN1)NCCC(C2=CC=C(C=C2)Br)C3=CC=CC=N3

InChI

InChI=1S/C22H27BrN6/c1-24-22(27-13-4-5-19-15-25-16-29-19)28-14-11-20(21-6-2-3-12-26-21)17-7-9-18(23)10-8-17/h2-3,6-10,12,15-16,20H,4-5,11,13-14H2,1H3,(H,25,29)(H2,24,27,28)