3-[2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 3-[2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 3-[2-(4-morpholinoanilino)pyrimidin-4-yl]benzonitrile CAS Name: 3-[2-[4-(4-morpholinyl)anilino]-4-pyrimidinyl]benzonitrile IUPAC Name: 3-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]benzonitrile Traditional Name: 3-[2-(4-morpholinoanilino)pyrimidin-4-yl]benzonitrile Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H19N5O/c22-15-16-2-1-3-17(14-16)20-8-9-23-21(25-20)24-18-4-6-19(7-5-18)26-10-12-27-13-11-26/h1-9,14H,10-13H2,(H,23,24,25)