(5,5-dimethyl-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-yl)-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-oxidanyl-azanium

Systemtic Name: (5,5-dimethyl-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-yl)-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-oxidanyl-azanium Openeye Name: (3-allyl-5,5-dimethyl-2-thioxo-thiazolidin-4-yl)-hydroxy-[3-(5-nitro-2-furyl)prop-2-enylidene]ammonium CAS Name: (5,5-dimethyl-3-prop-2-enyl-2-sulfanylidene-4-thiazolidinyl)-hydroxy-[3-(5-nitro-2-furanyl)prop-2-enylidene]ammonium IUPAC Name: (5,5-dimethyl-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-yl)-hydroxy-[3-(5-nitrofuran-2-yl)prop-2-enylidene]azanium Traditional Name: (3-allyl-5,5-dimethyl-2-thioxo-thiazolidin-4-yl)-hydroxy-[3-(5-nitro-2-furyl)prop-2-enylidene]ammonium Formula: C15H18N3O4S2+ MolecularWeight: 368.45112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N3O4S2/c1-4-9-16-13(15(2,3)24-14(16)23)17(19)10-5-6-11-7-8-12(22-11)18(20)21/h4-8,10,13,19H,1,9H2,2-3H3/q+1