N-[(2R)-3-[[2-[bis(fluoranyl)methoxy]phenyl]methylsulfanyl]-1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[(2R)-3-[[2-[bis(fluoranyl)methoxy]phenyl]methylsulfanyl]-1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[(1R)-2-(cyanomethylamino)-1-[[2-(difluoromethoxy)phenyl]methylsulfanylmethyl]-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[(2R)-1-(cyanomethylamino)-3-[[2-(difluoromethoxy)phenyl]methylthio]-1-oxopropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[(2R)-1-(cyanomethylamino)-3-[[2-(difluoromethoxy)phenyl]methylsulfanyl]-1-oxopropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[(1R)-2-(cyanomethylamino)-1-[[[2-(difluoromethoxy)benzyl]thio]methyl]-2-keto-ethyl]morpholine-4-carboxamide Formula: C18H22F2N4O4S MolecularWeight: 428.453486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)NC(CSCC2=CC=CC=C2OC(F)F)C(=O)NCC#N

Isomeric SMILES

C1COCCN1C(=O)N[C@@H](CSCC2=CC=CC=C2OC(F)F)C(=O)NCC#N

InChI

InChI=1S/C18H22F2N4O4S/c19-17(20)28-15-4-2-1-3-13(15)11-29-12-14(16(25)22-6-5-21)23-18(26)24-7-9-27-10-8-24/h1-4,14,17H,6-12H2,(H,22,25)(H,23,26)/t14-/m0/s1