2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanyl-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-[[6-(2,6-dimethyl-4-morpholinyl)-4-pyrimidinyl]thio]-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanyl-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-[[6-(2,6-dimethylmorpholino)pyrimidin-4-yl]thio]-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C18H20FN5O4S MolecularWeight: 421.445903

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=CC(=NC=N2)SCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=CC(=NC=N2)SCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H20FN5O4S/c1-11-7-23(8-12(2)28-11)16-6-18(21-10-20-16)29-9-17(25)22-13-3-4-14(19)15(5-13)24(26)27/h3-6,10-12H,7-9H2,1-2H3,(H,22,25)