2-[[5-bromanyl-2-[[3-(2-morpholin-4-ylethyl)phenyl]amino]pyrimidin-4-yl]amino]-N-butan-2-yl-benzamide

Systemtic Name: 2-[[5-bromanyl-2-[[3-(2-morpholin-4-ylethyl)phenyl]amino]pyrimidin-4-yl]amino]-N-butan-2-yl-benzamide Openeye Name: 2-[[5-bromo-2-[3-(2-morpholinoethyl)anilino]pyrimidin-4-yl]amino]-N-sec-butyl-benzamide CAS Name: 2-[[5-bromo-2-[3-[2-(4-morpholinyl)ethyl]anilino]-4-pyrimidinyl]amino]-N-butan-2-ylbenzamide IUPAC Name: 2-[[5-bromo-2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]amino]-N-butan-2-ylbenzamide Traditional Name: 2-[[5-bromo-2-[3-(2-morpholinoethyl)anilino]pyrimidin-4-yl]amino]-N-sec-butyl-benzamide Formula: C27H33BrN6O2 MolecularWeight: 553.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Br)NC3=CC=CC(=C3)CCN4CCOCC4

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC2=NC(=NC=C2Br)NC3=CC=CC(=C3)CCN4CCOCC4

InChI

InChI=1S/C27H33BrN6O2/c1-3-19(2)30-26(35)22-9-4-5-10-24(22)32-25-23(28)18-29-27(33-25)31-21-8-6-7-20(17-21)11-12-34-13-15-36-16-14-34/h4-10,17-19H,3,11-16H2,1-2H3,(H,30,35)(H2,29,31,32,33)