4-iodanyl-N-[4-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide

Systemtic Name: 4-iodanyl-N-[4-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide Openeye Name: 4-iodo-N-[4-[(4-methyl-6-morpholino-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide CAS Name: 4-iodo-N-[4-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: 4-iodo-N-[4-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)amino]phenyl]benzenesulfonamide Traditional Name: 4-iodo-N-[4-[(4-methyl-6-morpholino-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide Formula: C21H22IN5O3S MolecularWeight: 551.40055

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)I)N4CCOCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)I)N4CCOCC4

InChI

InChI=1S/C21H22IN5O3S/c1-15-14-20(27-10-12-30-13-11-27)25-21(23-15)24-17-4-6-18(7-5-17)26-31(28,29)19-8-2-16(22)3-9-19/h2-9,14,26H,10-13H2,1H3,(H,23,24,25)