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

Systemtic Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[3-[(2-pyrimidin-4-ylphenyl)amino]phenyl]benzamide Openeye Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[3-(2-pyrimidin-4-ylanilino)phenyl]benzamide CAS Name: 4-[(4-methyl-1-piperazinyl)methyl]-N-[3-[2-(4-pyrimidinyl)anilino]phenyl]benzamide IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[3-(2-pyrimidin-4-ylanilino)phenyl]benzamide Traditional Name: 4-[(4-methylpiperazino)methyl]-N-[3-[2-(4-pyrimidyl)anilino]phenyl]benzamide Formula: C29H30N6O MolecularWeight: 478.5881

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)NC4=CC=CC=C4C5=NC=NC=C5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)NC4=CC=CC=C4C5=NC=NC=C5

InChI

InChI=1S/C29H30N6O/c1-34-15-17-35(18-16-34)20-22-9-11-23(12-10-22)29(36)33-25-6-4-5-24(19-25)32-28-8-3-2-7-26(28)27-13-14-30-21-31-27/h2-14,19,21,32H,15-18,20H2,1H3,(H,33,36)