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

Systemtic Name: N-[4-methyl-3-[(4-methylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[4-methyl-3-[(4-methylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide CAS Name: N-[4-methyl-3-[(4-methyl-2-pyrimidinyl)amino]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[4-methyl-3-[(4-methylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[4-methyl-3-[(4-methylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazino)methyl]benzamide Formula: C25H30N6O MolecularWeight: 430.5453

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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=CC(=N4)C

Isomeric SMILES

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

InChI

InChI=1S/C25H30N6O/c1-18-4-9-22(16-23(18)29-25-26-11-10-19(2)27-25)28-24(32)21-7-5-20(6-8-21)17-31-14-12-30(3)13-15-31/h4-11,16H,12-15,17H2,1-3H3,(H,28,32)(H,26,27,29)