N-(1-cyanocyclopropyl)-4-[2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]benzamide

Systemtic Name: N-(1-cyanocyclopropyl)-4-[2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]benzamide Openeye Name: N-(1-cyanocyclopropyl)-4-[2-(4-morpholinoanilino)pyrimidin-4-yl]benzamide CAS Name: N-(1-cyanocyclopropyl)-4-[2-[4-(4-morpholinyl)anilino]-4-pyrimidinyl]benzamide IUPAC Name: N-(1-cyanocyclopropyl)-4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]benzamide Traditional Name: N-(1-cyanocyclopropyl)-4-[2-(4-morpholinoanilino)pyrimidin-4-yl]benzamide Formula: C25H24N6O2 MolecularWeight: 440.49706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#N)NC(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CC1(C#N)NC(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C25H24N6O2/c26-17-25(10-11-25)30-23(32)19-3-1-18(2-4-19)22-9-12-27-24(29-22)28-20-5-7-21(8-6-20)31-13-15-33-16-14-31/h1-9,12H,10-11,13-16H2,(H,30,32)(H,27,28,29)