[2,6-dimethoxy-4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]phenyl] ethanoate

Systemtic Name: [2,6-dimethoxy-4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]phenyl] ethanoate Openeye Name: [2,6-dimethoxy-4-[(E)-(5-phenyl-2-thioxo-1H-imidazol-3-yl)iminomethyl]phenyl] acetate CAS Name: acetic acid [2,6-dimethoxy-4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]phenyl] ester IUPAC Name: [2,6-dimethoxy-4-[(E)-(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]phenyl] acetate Traditional Name: acetic acid [2,6-dimethoxy-4-[(E)-(4-phenyl-2-thioxo-4-imidazolin-1-yl)iminomethyl]phenyl] ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C=NN2C=C(NC2=S)C3=CC=CC=C3)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)/C=N/N2C=C(NC2=S)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H19N3O4S/c1-13(24)27-19-17(25-2)9-14(10-18(19)26-3)11-21-23-12-16(22-20(23)28)15-7-5-4-6-8-15/h4-12H,1-3H3,(H,22,28)/b21-11+