2-[6-methyl-2-[2-(4-nitrothiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-yl]sulfanyl-1-(4-nitrothiophen-2-yl)ethanone

Systemtic Name: 2-[6-methyl-2-[2-(4-nitrothiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-yl]sulfanyl-1-(4-nitrothiophen-2-yl)ethanone Openeye Name: 2-[6-methyl-2-[2-(4-nitro-2-thienyl)-2-oxo-ethyl]sulfanyl-pyrimidin-4-yl]sulfanyl-1-(4-nitro-2-thienyl)ethanone CAS Name: 2-[[6-methyl-2-[[2-(4-nitro-2-thiophenyl)-2-oxoethyl]thio]-4-pyrimidinyl]thio]-1-(4-nitro-2-thiophenyl)ethanone IUPAC Name: 2-[6-methyl-2-[2-(4-nitrothiophen-2-yl)-2-oxoethyl]sulfanylpyrimidin-4-yl]sulfanyl-1-(4-nitrothiophen-2-yl)ethanone Traditional Name: 2-[[2-[[2-keto-2-(4-nitro-2-thienyl)ethyl]thio]-6-methyl-pyrimidin-4-yl]thio]-1-(4-nitro-2-thienyl)ethanone Formula: C17H12N4O6S4 MolecularWeight: 496.56038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)C2=CC(=CS2)[N+](=O)[O-])SCC(=O)C3=CC(=CS3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)C2=CC(=CS2)[N+](=O)[O-])SCC(=O)C3=CC(=CS3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O6S4/c1-9-2-16(30-7-12(22)14-3-10(5-28-14)20(24)25)19-17(18-9)31-8-13(23)15-4-11(6-29-15)21(26)27/h2-6H,7-8H2,1H3