S-ethyl N-[4-azanyl-3-[2,4-bis(fluoranyl)phenoxy]phenyl]carbonyliminocarbamothioate

Systemtic Name: S-ethyl N-[4-azanyl-3-[2,4-bis(fluoranyl)phenoxy]phenyl]carbonyliminocarbamothioate Openeye Name: S-ethyl N-[4-amino-3-(2,4-difluorophenoxy)benzoyl]iminocarbamothioate CAS Name: N-[[4-amino-3-(2,4-difluorophenoxy)phenyl]-oxomethyl]iminocarbamothioic acid S-ethyl ester IUPAC Name: S-ethyl N-[4-amino-3-(2,4-difluorophenoxy)benzoyl]iminocarbamothioate Traditional Name: N-[4-amino-3-(2,4-difluorophenoxy)benzoyl]iminothiocarbamic acid S-ethyl ester Formula: C16H13F2N3O3S MolecularWeight: 365.354526

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)N=NC(=O)C1=CC(=C(C=C1)N)OC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCSC(=O)N=NC(=O)C1=CC(=C(C=C1)N)OC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C16H13F2N3O3S/c1-2-25-16(23)21-20-15(22)9-3-5-12(19)14(7-9)24-13-6-4-10(17)8-11(13)18/h3-8H,2,19H2,1H3