2-[[5-bromanyl-2-[(4-morpholin-4-yl-2-propoxy-phenyl)amino]pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide

Systemtic Name: 2-[[5-bromanyl-2-[(4-morpholin-4-yl-2-propoxy-phenyl)amino]pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide Openeye Name: 2-[[5-bromo-2-(4-morpholino-2-propoxy-anilino)pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide CAS Name: 2-[[5-bromo-2-[4-(4-morpholinyl)-2-propoxyanilino]-4-pyrimidinyl]amino]-N-methylbenzenesulfonamide IUPAC Name: 2-[[5-bromo-2-(4-morpholin-4-yl-2-propoxyanilino)pyrimidin-4-yl]amino]-N-methylbenzenesulfonamide Traditional Name: 2-[[5-bromo-2-(4-morpholino-2-propoxy-anilino)pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide Formula: C24H29BrN6O4S MolecularWeight: 577.49386

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)N2CCOCC2)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)NC)Br

Isomeric SMILES

CCCOC1=C(C=CC(=C1)N2CCOCC2)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)NC)Br

InChI

InChI=1S/C24H29BrN6O4S/c1-3-12-35-21-15-17(31-10-13-34-14-11-31)8-9-19(21)29-24-27-16-18(25)23(30-24)28-20-6-4-5-7-22(20)36(32,33)26-2/h4-9,15-16,26H,3,10-14H2,1-2H3,(H2,27,28,29,30)