N-[4-methyl-3-[[2-(3-morpholin-4-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide

Systemtic Name: N-[4-methyl-3-[[2-(3-morpholin-4-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide Openeye Name: N-[4-methyl-3-[[2-(3-morpholinopropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholino-pyridine-4-carboxamide CAS Name: N-[4-methyl-3-[[2-[3-(4-morpholinyl)propylamino]-4-pyrimidinyl]amino]phenyl]-2-(4-morpholinyl)-4-pyridinecarboxamide IUPAC Name: N-[4-methyl-3-[[2-(3-morpholin-4-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholin-4-ylpyridine-4-carboxamide Traditional Name: N-[4-methyl-3-[[2-(3-morpholinopropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholino-isonicotinamide Formula: C28H36N8O3 MolecularWeight: 532.63724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCOCC3)NC4=NC(=NC=C4)NCCCN5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCOCC3)NC4=NC(=NC=C4)NCCCN5CCOCC5

InChI

InChI=1S/C28H36N8O3/c1-21-3-4-23(32-27(37)22-5-8-29-26(19-22)36-13-17-39-18-14-36)20-24(21)33-25-6-9-31-28(34-25)30-7-2-10-35-11-15-38-16-12-35/h3-6,8-9,19-20H,2,7,10-18H2,1H3,(H,32,37)(H2,30,31,33,34)