3-cyclohexyl-2-[[2-(methylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]-N-[phenyl(pyridin-2-yl)methyl]propanamide

Systemtic Name: 3-cyclohexyl-2-[[2-(methylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]-N-[phenyl(pyridin-2-yl)methyl]propanamide Openeye Name: 3-cyclohexyl-2-[[2-(methylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]-N-[phenyl(2-pyridyl)methyl]propanamide CAS Name: 3-cyclohexyl-2-[[2-(methylamino)-6-(1-pyrrolyl)-4-pyrimidinyl]amino]-N-[phenyl(2-pyridinyl)methyl]propanamide IUPAC Name: 3-cyclohexyl-2-[[2-(methylamino)-6-pyrrol-1-ylpyrimidin-4-yl]amino]-N-[phenyl(pyridin-2-yl)methyl]propanamide Traditional Name: 3-cyclohexyl-2-[[2-(methylamino)-6-pyrrol-1-yl-pyrimidin-4-yl]amino]-N-[phenyl(2-pyridyl)methyl]propionamide Formula: C30H35N7O MolecularWeight: 509.6452

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=CC(=N1)NC(CC2CCCCC2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=N4)N5C=CC=C5

Isomeric SMILES

CNC1=NC(=CC(=N1)NC(CC2CCCCC2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=N4)N5C=CC=C5

InChI

InChI=1S/C30H35N7O/c1-31-30-34-26(21-27(35-30)37-18-10-11-19-37)33-25(20-22-12-4-2-5-13-22)29(38)36-28(23-14-6-3-7-15-23)24-16-8-9-17-32-24/h3,6-11,14-19,21-22,25,28H,2,4-5,12-13,20H2,1H3,(H,36,38)(H2,31,33,34,35)