3-[[4-[(5-oxidanyl-2-propan-2-yl-phenyl)amino]pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-[(5-oxidanyl-2-propan-2-yl-phenyl)amino]pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-(5-hydroxy-2-isopropyl-anilino)pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-(5-hydroxy-2-propan-2-ylanilino)-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-(5-hydroxy-2-propan-2-ylanilino)pyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-(5-hydroxy-2-isopropyl-anilino)pyrimidin-2-yl]amino]benzamide Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)O)NC2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)O)NC2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C20H21N5O2/c1-12(2)16-7-6-15(26)11-17(16)24-18-8-9-22-20(25-18)23-14-5-3-4-13(10-14)19(21)27/h3-12,26H,1-2H3,(H2,21,27)(H2,22,23,24,25)