tert-butyl N-[[4-[bis(fluoranyl)methoxy]phenyl]carbamothioylamino]carbamate

Systemtic Name: tert-butyl N-[[4-[bis(fluoranyl)methoxy]phenyl]carbamothioylamino]carbamate Openeye Name: tert-butyl N-[[4-(difluoromethoxy)phenyl]carbamothioylamino]carbamate CAS Name: N-[[[4-(difluoromethoxy)anilino]-sulfanylidenemethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-(difluoromethoxy)phenyl]carbamothioylamino]carbamate Traditional Name: N-[[4-(difluoromethoxy)phenyl]thiocarbamoylamino]carbamic acid tert-butyl ester Formula: C13H17F2N3O3S MolecularWeight: 333.354186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=S)NC1=CC=C(C=C1)OC(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=S)NC1=CC=C(C=C1)OC(F)F

InChI

InChI=1S/C13H17F2N3O3S/c1-13(2,3)21-12(19)18-17-11(22)16-8-4-6-9(7-5-8)20-10(14)15/h4-7,10H,1-3H3,(H,18,19)(H2,16,17,22)