3-(5-nitrofuran-2-yl)prop-2-enylidene-oxidanyl-(3,5,5-trimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl)azanium

Systemtic Name: 3-(5-nitrofuran-2-yl)prop-2-enylidene-oxidanyl-(3,5,5-trimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl)azanium Openeye Name: hydroxy-[3-(5-nitro-2-furyl)prop-2-enylidene]-(3,5,5-trimethyl-2-thioxo-thiazolidin-4-yl)ammonium CAS Name: hydroxy-[3-(5-nitro-2-furanyl)prop-2-enylidene]-(3,5,5-trimethyl-2-sulfanylidene-4-thiazolidinyl)ammonium IUPAC Name: hydroxy-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-(3,5,5-trimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl)azanium Traditional Name: hydroxy-[3-(5-nitro-2-furyl)prop-2-enylidene]-(3,5,5-trimethyl-2-thioxo-thiazolidin-4-yl)ammonium Formula: C13H16N3O4S2+ MolecularWeight: 342.41384

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C(=S)S1)C)[N+](=CC=CC2=CC=C(O2)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C(N(C(=S)S1)C)[N+](=CC=CC2=CC=C(O2)[N+](=O)[O-])O)C

InChI

InChI=1S/C13H16N3O4S2/c1-13(2)11(14(3)12(21)22-13)15(17)8-4-5-9-6-7-10(20-9)16(18)19/h4-8,11,17H,1-3H3/q+1