4-[(4-ethylpiperazin-1-yl)-fluoranyl-methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide

Systemtic Name: 4-[(4-ethylpiperazin-1-yl)-fluoranyl-methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 4-[(4-ethylpiperazin-1-yl)-fluoro-methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-[(4-ethyl-1-piperazinyl)-fluoromethyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 4-[(4-ethylpiperazin-1-yl)-fluoromethyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 4-[(4-ethylpiperazino)-fluoro-methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide Formula: C30H32FN7O MolecularWeight: 525.619783

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)NC4=NC=CC(=N4)C5=CN=CC=C5)F

Isomeric SMILES

CCN1CCN(CC1)C(C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)NC4=NC=CC(=N4)C5=CN=CC=C5)F

InChI

InChI=1S/C30H32FN7O/c1-3-37-15-17-38(18-16-37)28(31)22-7-9-23(10-8-22)29(39)34-25-11-6-21(2)27(19-25)36-30-33-14-12-26(35-30)24-5-4-13-32-20-24/h4-14,19-20,28H,3,15-18H2,1-2H3,(H,34,39)(H,33,35,36)