2-[[2-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]amino]pyrimidin-4-yl]amino]-1-phenyl-ethanol

Systemtic Name: 2-[[2-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]amino]pyrimidin-4-yl]amino]-1-phenyl-ethanol Openeye Name: 2-[[2-[4-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]amino]-1-phenyl-ethanol CAS Name: 2-[[2-[4-[(4-methyl-1-piperazinyl)methyl]anilino]-4-pyrimidinyl]amino]-1-phenylethanol IUPAC Name: 2-[[2-[4-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]amino]-1-phenylethanol Traditional Name: 2-[[2-[4-[(4-methylpiperazino)methyl]anilino]pyrimidin-4-yl]amino]-1-phenyl-ethanol Formula: C24H30N6O MolecularWeight: 418.5346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)NC3=NC=CC(=N3)NCC(C4=CC=CC=C4)O

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)NC3=NC=CC(=N3)NCC(C4=CC=CC=C4)O

InChI

InChI=1S/C24H30N6O/c1-29-13-15-30(16-14-29)18-19-7-9-21(10-8-19)27-24-25-12-11-23(28-24)26-17-22(31)20-5-3-2-4-6-20/h2-12,22,31H,13-18H2,1H3,(H2,25,26,27,28)