4-[(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)amino]-N-(2-pyridin-4-ylethyl)benzamide

Systemtic Name: 4-[(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)amino]-N-(2-pyridin-4-ylethyl)benzamide Openeye Name: 4-[(2-amino-6-morpholino-pyrimidin-4-yl)amino]-N-[2-(4-pyridyl)ethyl]benzamide CAS Name: 4-[[2-amino-6-(4-morpholinyl)-4-pyrimidinyl]amino]-N-(2-pyridin-4-ylethyl)benzamide IUPAC Name: 4-[(2-amino-6-morpholin-4-ylpyrimidin-4-yl)amino]-N-(2-pyridin-4-ylethyl)benzamide Traditional Name: 4-[(2-amino-6-morpholino-pyrimidin-4-yl)amino]-N-[2-(4-pyridyl)ethyl]benzamide Formula: C22H25N7O2 MolecularWeight: 419.4796

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=NC(=N2)N)NC3=CC=C(C=C3)C(=O)NCCC4=CC=NC=C4

Isomeric SMILES

C1COCCN1C2=CC(=NC(=N2)N)NC3=CC=C(C=C3)C(=O)NCCC4=CC=NC=C4

InChI

InChI=1S/C22H25N7O2/c23-22-27-19(15-20(28-22)29-11-13-31-14-12-29)26-18-3-1-17(2-4-18)21(30)25-10-7-16-5-8-24-9-6-16/h1-6,8-9,15H,7,10-14H2,(H,25,30)(H3,23,26,27,28)