[4-azanyl-3-[2,4-bis(fluoranyl)phenoxy]phenyl]carbonyliminocarbamothioic S-acid

Systemtic Name: [4-azanyl-3-[2,4-bis(fluoranyl)phenoxy]phenyl]carbonyliminocarbamothioic S-acid Openeye Name: [4-amino-3-(2,4-difluorophenoxy)benzoyl]iminocarbamothioic S-acid CAS Name: [[4-amino-3-(2,4-difluorophenoxy)phenyl]-oxomethyl]iminocarbamothioic S-acid IUPAC Name: [4-amino-3-(2,4-difluorophenoxy)benzoyl]iminocarbamothioic S-acid Traditional Name: [4-amino-3-(2,4-difluorophenoxy)benzoyl]iminothiocarbamic S-acid Formula: C14H9F2N3O3S MolecularWeight: 337.301366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N=NC(=O)S)OC2=C(C=C(C=C2)F)F)N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N=NC(=O)S)OC2=C(C=C(C=C2)F)F)N

InChI

InChI=1S/C14H9F2N3O3S/c15-8-2-4-11(9(16)6-8)22-12-5-7(1-3-10(12)17)13(20)18-19-14(21)23/h1-6H,17H2,(H,21,23)