N-[4-methyl-3-[(5-methyl-4-pyridin-3-yl-pyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[4-methyl-3-[(5-methyl-4-pyridin-3-yl-pyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[4-methyl-3-[[5-methyl-4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide CAS Name: N-[4-methyl-3-[[5-methyl-4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[4-methyl-3-[(5-methyl-4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[4-methyl-3-[[5-methyl-4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-4-[(4-methylpiperazino)methyl]benzamide Formula: C30H33N7O MolecularWeight: 507.62932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)NC4=NC=C(C(=N4)C5=CN=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)NC4=NC=C(C(=N4)C5=CN=CC=C5)C

InChI

InChI=1S/C30H33N7O/c1-21-6-11-26(17-27(21)34-30-32-18-22(2)28(35-30)25-5-4-12-31-19-25)33-29(38)24-9-7-23(8-10-24)20-37-15-13-36(3)14-16-37/h4-12,17-19H,13-16,20H2,1-3H3,(H,33,38)(H,32,34,35)