[4-[(1,3-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-2-methoxy-phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(1,3-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-2-methoxy-phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[(1,3-dimethyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[(1,3-dimethyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(1,3-dimethyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]-2-methoxyphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(5-keto-1,3-dimethyl-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-phenyl] ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)N3C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)N3C)C)OC

InChI

InChI=1S/C20H20N2O5S2/c1-13-5-8-15(9-6-13)29(24,25)27-17-10-7-14(12-18(17)26-4)11-16-19(23)22(3)20(28)21(16)2/h5-12H,1-4H3