5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]propoxy]phenyl]pyrimidin-2-amine

Systemtic Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]propoxy]phenyl]pyrimidin-2-amine Openeye Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)-1-piperidyl]propoxy]phenyl]pyrimidin-2-amine CAS Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)-1-piperidinyl]propoxy]phenyl]-2-pyrimidinamine IUPAC Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]propoxy]phenyl]pyrimidin-2-amine Traditional Name: [5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidino]propoxy]phenyl]pyrimidin-2-yl]amine Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CN=CN2)CCCOC3=CC=C(C=C3)C4=CN=C(N=C4)N

Isomeric SMILES

C1CN(CCC1CC2=CN=CN2)CCCOC3=CC=C(C=C3)C4=CN=C(N=C4)N

InChI

InChI=1S/C22H28N6O/c23-22-25-13-19(14-26-22)18-2-4-21(5-3-18)29-11-1-8-28-9-6-17(7-10-28)12-20-15-24-16-27-20/h2-5,13-17H,1,6-12H2,(H,24,27)(H2,23,25,26)