methyl 6-[[[(2R)-2-(2-fluoranylphenoxy)propanoyl]amino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[[(2R)-2-(2-fluoranylphenoxy)propanoyl]amino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[[(2R)-2-(2-fluorophenoxy)propanoyl]amino]carbamothioylamino]hexanoate CAS Name: 6-[[[[(2R)-2-(2-fluorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[[(2R)-2-(2-fluorophenoxy)propanoyl]amino]carbamothioylamino]hexanoate Traditional Name: 6-[[[(2R)-2-(2-fluorophenoxy)propanoyl]amino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C17H24FN3O4S MolecularWeight: 385.453563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NCCCCCC(=O)OC)OC1=CC=CC=C1F

Isomeric SMILES

C[C@H](C(=O)NNC(=S)NCCCCCC(=O)OC)OC1=CC=CC=C1F

InChI

InChI=1S/C17H24FN3O4S/c1-12(25-14-9-6-5-8-13(14)18)16(23)20-21-17(26)19-11-7-3-4-10-15(22)24-2/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3,(H,20,23)(H2,19,21,26)/t12-/m1/s1