4-chloranyl-2-[(E)-(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(E)-(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(E)-(3-cyclohexyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[(E)-(3-cyclohexyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(E)-(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[(E)-(3-cyclohexyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Formula: C16H14ClN2O4S2- MolecularWeight: 397.87636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl)SC2=S

Isomeric SMILES

C1CCC(CC1)N2C(=O)/C(=C\C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl)/SC2=S

InChI

InChI=1S/C16H15ClN2O4S2/c17-10-6-9(14(20)12(8-10)19(22)23)7-13-15(21)18(16(24)25-13)11-4-2-1-3-5-11/h6-8,11,20H,1-5H2/p-1/b13-7+