3-[(3-azanyl-3-sulfanylidene-propyl)-methyl-carbamoyl]-2,5,6-tris(fluoranyl)phenolate

Systemtic Name: 3-[(3-azanyl-3-sulfanylidene-propyl)-methyl-carbamoyl]-2,5,6-tris(fluoranyl)phenolate Openeye Name: 3-[(3-amino-3-thioxo-propyl)-methyl-carbamoyl]-2,5,6-trifluoro-phenolate CAS Name: 3-[[(3-amino-3-sulfanylidenepropyl)-methylamino]-oxomethyl]-2,5,6-trifluorophenolate IUPAC Name: 3-[(3-amino-3-sulfanylidenepropyl)-methylcarbamoyl]-2,5,6-trifluorophenolate Traditional Name: 3-[(3-amino-3-thioxo-propyl)-methyl-carbamoyl]-2,5,6-trifluoro-phenolate Formula: C11H10F3N2O2S- MolecularWeight: 291.26951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C(=O)C1=CC(=C(C(=C1F)[O-])F)F

Isomeric SMILES

CN(CCC(=S)N)C(=O)C1=CC(=C(C(=C1F)[O-])F)F

InChI

InChI=1S/C11H11F3N2O2S/c1-16(3-2-7(15)19)11(18)5-4-6(12)9(14)10(17)8(5)13/h4,17H,2-3H2,1H3,(H2,15,19)/p-1