pentyl 2-[[2,5-bis(fluoranyl)phenyl]carbamothioylamino]ethanoate

Systemtic Name: pentyl 2-[[2,5-bis(fluoranyl)phenyl]carbamothioylamino]ethanoate Openeye Name: pentyl 2-[(2,5-difluorophenyl)carbamothioylamino]acetate CAS Name: 2-[[(2,5-difluoroanilino)-sulfanylidenemethyl]amino]acetic acid pentyl ester IUPAC Name: pentyl 2-[(2,5-difluorophenyl)carbamothioylamino]acetate Traditional Name: 2-[(2,5-difluorophenyl)thiocarbamoylamino]acetic acid amyl ester Formula: C14H18F2N2O2S MolecularWeight: 316.366726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CNC(=S)NC1=C(C=CC(=C1)F)F

Isomeric SMILES

CCCCCOC(=O)CNC(=S)NC1=C(C=CC(=C1)F)F

InChI

InChI=1S/C14H18F2N2O2S/c1-2-3-4-7-20-13(19)9-17-14(21)18-12-8-10(15)5-6-11(12)16/h5-6,8H,2-4,7,9H2,1H3,(H2,17,18,21)