[4-[(Z)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [4-[(Z)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [4-[(Z)-(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-[(Z)-(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]phenyl] ester IUPAC Name: [4-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [4-[(Z)-(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)C=C3C(=O)NC(=S)N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)/C=C\3/C(=O)NC(=S)N3

InChI

InChI=1S/C20H18N2O6S/c1-25-15-9-12(10-16(26-2)17(15)27-3)19(24)28-13-6-4-11(5-7-13)8-14-18(23)22-20(29)21-14/h4-10H,1-3H3,(H2,21,22,23,29)/b14-8-