[3-[(E)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [3-[(E)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [3-[(E)-(4-oxo-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-[(E)-(4-oxo-3-phenyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [3-[(E)-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-[(E)-(4-keto-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] ester Formula: C23H13N3O7S2 MolecularWeight: 507.49522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=CC=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])SC2=S

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC(=CC=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])/SC2=S

InChI

InChI=1S/C23H13N3O7S2/c27-21-20(35-23(34)24(21)16-6-2-1-3-7-16)10-14-5-4-8-19(9-14)33-22(28)15-11-17(25(29)30)13-18(12-15)26(31)32/h1-13H/b20-10+