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

Systemtic Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-[[(1-methylpyrrolidin-3-yl)amino]methyl]benzamide Openeye Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-4-[[(1-methylpyrrolidin-3-yl)amino]methyl]benzamide CAS Name: N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-[[(1-methyl-3-pyrrolidinyl)amino]methyl]benzamide IUPAC Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-[[(1-methylpyrrolidin-3-yl)amino]methyl]benzamide Traditional Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-4-[[(1-methylpyrrolidin-3-yl)amino]methyl]benzamide Formula: C29H31N7O MolecularWeight: 493.60274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CNC3CCN(C3)C)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CNC3CCN(C3)C)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C29H31N7O/c1-20-5-10-24(16-27(20)35-29-31-14-11-26(34-29)23-4-3-13-30-18-23)33-28(37)22-8-6-21(7-9-22)17-32-25-12-15-36(2)19-25/h3-11,13-14,16,18,25,32H,12,15,17,19H2,1-2H3,(H,33,37)(H,31,34,35)