2-[[5-bromanyl-2-[(2,4-dimethoxy-5-morpholin-4-yl-phenyl)amino]pyrimidin-4-yl]amino]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 2-[[5-bromanyl-2-[(2,4-dimethoxy-5-morpholin-4-yl-phenyl)amino]pyrimidin-4-yl]amino]-N-propan-2-yl-benzenesulfonamide Openeye Name: 2-[[5-bromo-2-(2,4-dimethoxy-5-morpholino-anilino)pyrimidin-4-yl]amino]-N-isopropyl-benzenesulfonamide CAS Name: 2-[[5-bromo-2-[2,4-dimethoxy-5-(4-morpholinyl)anilino]-4-pyrimidinyl]amino]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 2-[[5-bromo-2-(2,4-dimethoxy-5-morpholin-4-ylanilino)pyrimidin-4-yl]amino]-N-propan-2-ylbenzenesulfonamide Traditional Name: 2-[[5-bromo-2-(2,4-dimethoxy-5-morpholino-anilino)pyrimidin-4-yl]amino]-N-isopropyl-benzenesulfonamide Formula: C25H31BrN6O5S MolecularWeight: 607.51984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2Br)NC3=C(C=C(C(=C3)N4CCOCC4)OC)OC

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2Br)NC3=C(C=C(C(=C3)N4CCOCC4)OC)OC

InChI

InChI=1S/C25H31BrN6O5S/c1-16(2)31-38(33,34)23-8-6-5-7-18(23)28-24-17(26)15-27-25(30-24)29-19-13-20(32-9-11-37-12-10-32)22(36-4)14-21(19)35-3/h5-8,13-16,31H,9-12H2,1-4H3,(H2,27,28,29,30)