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

Systemtic Name: 1-[3-(4-bromophenyl)-3-pyridin-2-yl-propyl]-2-[3-(1H-imidazol-5-yl)propyl]-3-phenyl-guanidine Openeye Name: 1-[3-(4-bromophenyl)-3-(2-pyridyl)propyl]-2-[3-(1H-imidazol-5-yl)propyl]-3-phenyl-guanidine CAS Name: 1-[3-(4-bromophenyl)-3-(2-pyridinyl)propyl]-2-[3-(1H-imidazol-5-yl)propyl]-3-phenylguanidine IUPAC Name: 1-[3-(4-bromophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]-3-phenylguanidine Traditional Name: 1-[3-(4-bromophenyl)-3-(2-pyridyl)propyl]-2-[3-(1H-imidazol-5-yl)propyl]-3-phenyl-guanidine Formula: C27H29BrN6 MolecularWeight: 517.46336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=NCCCC2=CN=CN2)NCCC(C3=CC=C(C=C3)Br)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)NC(=NCCCC2=CN=CN2)NCCC(C3=CC=C(C=C3)Br)C4=CC=CC=N4

InChI

InChI=1S/C27H29BrN6/c28-22-13-11-21(12-14-22)25(26-10-4-5-16-30-26)15-18-32-27(34-23-7-2-1-3-8-23)31-17-6-9-24-19-29-20-33-24/h1-5,7-8,10-14,16,19-20,25H,6,9,15,17-18H2,(H,29,33)(H2,31,32,34)