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

Systemtic Name: 2-[[5-cyano-2-[(2-ethyl-4-morpholin-4-yl-phenyl)amino]pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide Openeye Name: 2-[[5-cyano-2-(2-ethyl-4-morpholino-anilino)pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide CAS Name: 2-[[5-cyano-2-[2-ethyl-4-(4-morpholinyl)anilino]-4-pyrimidinyl]amino]-N-methylbenzenesulfonamide IUPAC Name: 2-[[5-cyano-2-(2-ethyl-4-morpholin-4-ylanilino)pyrimidin-4-yl]amino]-N-methylbenzenesulfonamide Traditional Name: 2-[[5-cyano-2-(2-ethyl-4-morpholino-anilino)pyrimidin-4-yl]amino]-N-methyl-benzenesulfonamide Formula: C24H27N7O3S MolecularWeight: 493.58128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)N2CCOCC2)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)NC)C#N

Isomeric SMILES

CCC1=C(C=CC(=C1)N2CCOCC2)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)NC)C#N

InChI

InChI=1S/C24H27N7O3S/c1-3-17-14-19(31-10-12-34-13-11-31)8-9-20(17)29-24-27-16-18(15-25)23(30-24)28-21-6-4-5-7-22(21)35(32,33)26-2/h4-9,14,16,26H,3,10-13H2,1-2H3,(H2,27,28,29,30)