1-cyano-3-[3-[[3-(4-fluorophenyl)-3-pyridin-2-yl-propyl]-methyl-amino]propyl]-2-[3-[4-(piperidin-1-ylmethyl)phenoxy]propyl]guanidine

Systemtic Name: 1-cyano-3-[3-[[3-(4-fluorophenyl)-3-pyridin-2-yl-propyl]-methyl-amino]propyl]-2-[3-[4-(piperidin-1-ylmethyl)phenoxy]propyl]guanidine Openeye Name: 1-cyano-3-[3-[[3-(4-fluorophenyl)-3-(2-pyridyl)propyl]-methyl-amino]propyl]-2-[3-[4-(1-piperidylmethyl)phenoxy]propyl]guanidine CAS Name: 1-cyano-3-[3-[[3-(4-fluorophenyl)-3-(2-pyridinyl)propyl]-methylamino]propyl]-2-[3-[4-(1-piperidinylmethyl)phenoxy]propyl]guanidine IUPAC Name: 1-cyano-3-[3-[[3-(4-fluorophenyl)-3-pyridin-2-ylpropyl]-methylamino]propyl]-2-[3-[4-(piperidin-1-ylmethyl)phenoxy]propyl]guanidine Traditional Name: 1-cyano-3-[3-[[3-(4-fluorophenyl)-3-(2-pyridyl)propyl]-methyl-amino]propyl]-2-[3-[4-(piperidinomethyl)phenoxy]propyl]guanidine Formula: C35H46FN7O MolecularWeight: 599.784443

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=NCCCOC1=CC=C(C=C1)CN2CCCCC2)NC#N)CCC(C3=CC=C(C=C3)F)C4=CC=CC=N4

Isomeric SMILES

CN(CCCNC(=NCCCOC1=CC=C(C=C1)CN2CCCCC2)NC#N)CCC(C3=CC=C(C=C3)F)C4=CC=CC=N4

InChI

InChI=1S/C35H46FN7O/c1-42(25-18-33(34-9-3-4-19-38-34)30-12-14-31(36)15-13-30)22-7-20-39-35(41-28-37)40-21-8-26-44-32-16-10-29(11-17-32)27-43-23-5-2-6-24-43/h3-4,9-17,19,33H,2,5-8,18,20-27H2,1H3,(H2,39,40,41)