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

Systemtic Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]propoxy]phenyl]pyrimidine Openeye Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)-1-piperidyl]propoxy]phenyl]pyrimidine CAS Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)-1-piperidinyl]propoxy]phenyl]pyrimidine IUPAC Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]propoxy]phenyl]pyrimidine Traditional Name: 5-[4-[3-[4-(1H-imidazol-5-ylmethyl)piperidino]propoxy]phenyl]pyrimidine Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O/c1(8-27-9-6-18(7-10-27)12-21-15-25-17-26-21)11-28-22-4-2-19(3-5-22)20-13-23-16-24-14-20/h2-5,13-18H,1,6-12H2,(H,25,26)