2-[[3-[2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]phenyl]methylamino]ethanenitrile

Systemtic Name: 2-[[3-[2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]phenyl]methylamino]ethanenitrile Openeye Name: 2-[[3-[2-(4-morpholinoanilino)pyrimidin-4-yl]phenyl]methylamino]acetonitrile CAS Name: 2-[[3-[2-[4-(4-morpholinyl)anilino]-4-pyrimidinyl]phenyl]methylamino]acetonitrile IUPAC Name: 2-[[3-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]methylamino]acetonitrile Traditional Name: 2-[[3-[2-(4-morpholinoanilino)pyrimidin-4-yl]benzyl]amino]acetonitrile Formula: C23H24N6O MolecularWeight: 400.47626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N6O/c24-9-11-25-17-18-2-1-3-19(16-18)22-8-10-26-23(28-22)27-20-4-6-21(7-5-20)29-12-14-30-15-13-29/h1-8,10,16,25H,11-15,17H2,(H,26,27,28)