methyl 4-[[[2,4-bis(fluoranyl)phenyl]amino]carbamothioylamino]butanoate

Systemtic Name: methyl 4-[[[2,4-bis(fluoranyl)phenyl]amino]carbamothioylamino]butanoate Openeye Name: methyl 4-[(2,4-difluoroanilino)carbamothioylamino]butanoate CAS Name: 4-[[[(2,4-difluorophenyl)hydrazo]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(2,4-difluoroanilino)carbamothioylamino]butanoate Traditional Name: 4-[(2,4-difluoroanilino)thiocarbamoylamino]butyric acid methyl ester Formula: C12H15F2N3O2S MolecularWeight: 303.328206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=S)NNC1=C(C=C(C=C1)F)F

Isomeric SMILES

COC(=O)CCCNC(=S)NNC1=C(C=C(C=C1)F)F

InChI

InChI=1S/C12H15F2N3O2S/c1-19-11(18)3-2-6-15-12(20)17-16-10-5-4-8(13)7-9(10)14/h4-5,7,16H,2-3,6H2,1H3,(H2,15,17,20)