4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]-N-[3-(pyrrolidin-1-ylmethyl)pyridin-2-yl]benzamide

Systemtic Name: 4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]-N-[3-(pyrrolidin-1-ylmethyl)pyridin-2-yl]benzamide Openeye Name: 4-methyl-3-[(3-pyrimidin-4-yl-2-pyridyl)amino]-N-[3-(pyrrolidin-1-ylmethyl)-2-pyridyl]benzamide CAS Name: 4-methyl-3-[[3-(4-pyrimidinyl)-2-pyridinyl]amino]-N-[3-(1-pyrrolidinylmethyl)-2-pyridinyl]benzamide IUPAC Name: 4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]-N-[3-(pyrrolidin-1-ylmethyl)pyridin-2-yl]benzamide Traditional Name: 4-methyl-3-[[3-(4-pyrimidyl)-2-pyridyl]amino]-N-[3-(pyrrolidinomethyl)-2-pyridyl]benzamide Formula: C27H27N7O MolecularWeight: 465.54958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=N2)CN3CCCC3)NC4=C(C=CC=N4)C5=NC=NC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=N2)CN3CCCC3)NC4=C(C=CC=N4)C5=NC=NC=C5

InChI

InChI=1S/C27H27N7O/c1-19-8-9-20(27(35)33-25-21(6-4-11-29-25)17-34-14-2-3-15-34)16-24(19)32-26-22(7-5-12-30-26)23-10-13-28-18-31-23/h4-13,16,18H,2-3,14-15,17H2,1H3,(H,30,32)(H,29,33,35)