tert-butyl N-[(2-fluoranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]carbamate

Systemtic Name: tert-butyl N-[(2-fluoranyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylamino]carbamate Openeye Name: tert-butyl N-[(2-fluoro-5-morpholinosulfonyl-benzoyl)amino]carbamate CAS Name: N-[[[2-fluoro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-fluoro-5-morpholin-4-ylsulfonylbenzoyl)amino]carbamate Traditional Name: N-[(2-fluoro-5-morpholinosulfonyl-benzoyl)amino]carbamic acid tert-butyl ester Formula: C16H22FN3O6S MolecularWeight: 403.425783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)F

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)F

InChI

InChI=1S/C16H22FN3O6S/c1-16(2,3)26-15(22)19-18-14(21)12-10-11(4-5-13(12)17)27(23,24)20-6-8-25-9-7-20/h4-5,10H,6-9H2,1-3H3,(H,18,21)(H,19,22)