4-[2-(2-azanylethylamino)-6-morpholin-4-yl-pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(2-azanylethylamino)-6-morpholin-4-yl-pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[2-(2-aminoethylamino)-6-morpholino-pyrimidin-4-yl]benzonitrile CAS Name: 4-[2-(2-aminoethylamino)-6-(4-morpholinyl)-4-pyrimidinyl]benzonitrile IUPAC Name: 4-[2-(2-aminoethylamino)-6-morpholin-4-ylpyrimidin-4-yl]benzonitrile Traditional Name: 4-[2-(2-aminoethylamino)-6-morpholino-pyrimidin-4-yl]benzonitrile Formula: C17H20N6O MolecularWeight: 324.3803

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=C2)C3=CC=C(C=C3)C#N)NCCN

Isomeric SMILES

C1COCCN1C2=NC(=NC(=C2)C3=CC=C(C=C3)C#N)NCCN

InChI

InChI=1S/C17H20N6O/c18-5-6-20-17-21-15(14-3-1-13(12-19)2-4-14)11-16(22-17)23-7-9-24-10-8-23/h1-4,11H,5-10,18H2,(H,20,21,22)