4-[4-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butoxy]phenol

Systemtic Name: 4-[4-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butoxy]phenol Openeye Name: 4-[4-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butoxy]phenol CAS Name: 4-[4-[4-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]butoxy]phenol IUPAC Name: 4-[4-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]butoxy]phenol Traditional Name: 4-[4-[4-(2,6-dipyrrolidinopyrimidin-4-yl)piperazino]butoxy]phenol Formula: C26H38N6O2 MolecularWeight: 466.61892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)CCCCOC5=CC=C(C=C5)O

Isomeric SMILES

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)CCCCOC5=CC=C(C=C5)O

InChI

InChI=1S/C26H38N6O2/c33-22-7-9-23(10-8-22)34-20-6-5-11-29-16-18-31(19-17-29)25-21-24(30-12-1-2-13-30)27-26(28-25)32-14-3-4-15-32/h7-10,21,33H,1-6,11-20H2