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

Systemtic Name: 4-methyl-N-(4-piperidin-1-ylphenyl)-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]benzamide Openeye Name: 4-methyl-N-[4-(1-piperidyl)phenyl]-3-[(3-pyrimidin-4-yl-2-pyridyl)amino]benzamide CAS Name: 4-methyl-N-[4-(1-piperidinyl)phenyl]-3-[[3-(4-pyrimidinyl)-2-pyridinyl]amino]benzamide IUPAC Name: 4-methyl-N-(4-piperidin-1-ylphenyl)-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]benzamide Traditional Name: 4-methyl-N-(4-piperidinophenyl)-3-[[3-(4-pyrimidyl)-2-pyridyl]amino]benzamide Formula: C28H28N6O MolecularWeight: 464.56152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCCCC3)NC4=C(C=CC=N4)C5=NC=NC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCCCC3)NC4=C(C=CC=N4)C5=NC=NC=C5

InChI

InChI=1S/C28H28N6O/c1-20-7-8-21(28(35)32-22-9-11-23(12-10-22)34-16-3-2-4-17-34)18-26(20)33-27-24(6-5-14-30-27)25-13-15-29-19-31-25/h5-15,18-19H,2-4,16-17H2,1H3,(H,30,33)(H,32,35)