N-[4-methyl-3-[[2-(3-pyrrolidin-1-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide

Systemtic Name: N-[4-methyl-3-[[2-(3-pyrrolidin-1-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide Openeye Name: N-[4-methyl-3-[[2-(3-pyrrolidin-1-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholino-pyridine-4-carboxamide CAS Name: N-[4-methyl-3-[[2-[3-(1-pyrrolidinyl)propylamino]-4-pyrimidinyl]amino]phenyl]-2-(4-morpholinyl)-4-pyridinecarboxamide IUPAC Name: N-[4-methyl-3-[[2-(3-pyrrolidin-1-ylpropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholin-4-ylpyridine-4-carboxamide Traditional Name: N-[4-methyl-3-[[2-(3-pyrrolidinopropylamino)pyrimidin-4-yl]amino]phenyl]-2-morpholino-isonicotinamide Formula: C28H36N8O2 MolecularWeight: 516.63784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCOCC3)NC4=NC(=NC=C4)NCCCN5CCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCOCC3)NC4=NC(=NC=C4)NCCCN5CCCC5

InChI

InChI=1S/C28H36N8O2/c1-21-5-6-23(32-27(37)22-7-10-29-26(19-22)36-15-17-38-18-16-36)20-24(21)33-25-8-11-31-28(34-25)30-9-4-14-35-12-2-3-13-35/h5-8,10-11,19-20H,2-4,9,12-18H2,1H3,(H,32,37)(H2,30,31,33,34)