[2-methoxy-4-[[3-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl] methanesulfonate

Systemtic Name: [2-methoxy-4-[[3-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl] methanesulfonate Openeye Name: [2-methoxy-4-[[3-(3-nitrophenyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-methoxy-4-[[3-(3-nitrophenyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[[3-(3-nitrophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[4-keto-3-(3-nitrophenyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C18H14N2O7S3 MolecularWeight: 466.50796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=CC=C3)[N+](=O)[O-])OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=CC=C3)[N+](=O)[O-])OS(=O)(=O)C

InChI

InChI=1S/C18H14N2O7S3/c1-26-15-8-11(6-7-14(15)27-30(2,24)25)9-16-17(21)19(18(28)29-16)12-4-3-5-13(10-12)20(22)23/h3-10H,1-2H3