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

Systemtic Name: N-[4-methyl-3-[(4-phenylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[4-methyl-3-[(4-phenylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide CAS Name: N-[4-methyl-3-[(4-phenyl-2-pyrimidinyl)amino]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[4-methyl-3-[(4-phenylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[4-methyl-3-[(4-phenylpyrimidin-2-yl)amino]phenyl]-4-[(4-methylpiperazino)methyl]benzamide Formula: C30H32N6O MolecularWeight: 492.61468

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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)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C30H32N6O/c1-22-8-13-26(20-28(22)34-30-31-15-14-27(33-30)24-6-4-3-5-7-24)32-29(37)25-11-9-23(10-12-25)21-36-18-16-35(2)17-19-36/h3-15,20H,16-19,21H2,1-2H3,(H,32,37)(H,31,33,34)