4-[3-(dimethylamino)propyl-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[3-(dimethylamino)propyl-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[3-(dimethylamino)propyl-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[3-(dimethylamino)propyl-[4-(3-fluoro-4-methoxyphenyl)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[3-(dimethylamino)propyl-[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[3-(dimethylamino)propyl-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C22H26FN5O3S MolecularWeight: 459.536943

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C1=CC=C(C=C1)S(=O)(=O)N)C2=NC=CC(=N2)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CN(C)CCCN(C1=CC=C(C=C1)S(=O)(=O)N)C2=NC=CC(=N2)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C22H26FN5O3S/c1-27(2)13-4-14-28(17-6-8-18(9-7-17)32(24,29)30)22-25-12-11-20(26-22)16-5-10-21(31-3)19(23)15-16/h5-12,15H,4,13-14H2,1-3H3,(H2,24,29,30)