4-(7a-propyl-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyrimidin-2-amine

Systemtic Name: 4-(7a-propyl-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyrimidin-2-amine Openeye Name: 4-(7a-propyl-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)pyrimidin-2-amine CAS Name: 4-(7a-propyl-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-(7a-propyl-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyrimidin-2-amine Traditional Name: [4-(7a-propyl-1,7-dihydropyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]-(4-methyl-3-morpholinosulfonyl-phenyl)amine Formula: C25H30N6O3S MolecularWeight: 494.6091

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12C(=CC=CN1)C(=CN2)C3=NC(=NC=C3)NC4=CC(=C(C=C4)C)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CCCC12C(=CC=CN1)C(=CN2)C3=NC(=NC=C3)NC4=CC(=C(C=C4)C)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H30N6O3S/c1-3-9-25-21(5-4-10-27-25)20(17-28-25)22-8-11-26-24(30-22)29-19-7-6-18(2)23(16-19)35(32,33)31-12-14-34-15-13-31/h4-8,10-11,16-17,27-28H,3,9,12-15H2,1-2H3,(H,26,29,30)