[2-ethoxy-4-[(Z)-(5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] propanoate

Systemtic Name: [2-ethoxy-4-[(Z)-(5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] propanoate Openeye Name: [2-ethoxy-4-[(Z)-(5-oxo-1-phenyl-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] propanoate CAS Name: propanoic acid [2-ethoxy-4-[(Z)-(5-oxo-1-phenyl-2-sulfanylidene-4-imidazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(Z)-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl] propanoate Traditional Name: propionic acid [2-ethoxy-4-[(Z)-(5-keto-1-phenyl-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)N2)C3=CC=CC=C3)OCC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)N2)C3=CC=CC=C3)OCC

InChI

InChI=1S/C21H20N2O4S/c1-3-19(24)27-17-11-10-14(13-18(17)26-4-2)12-16-20(25)23(21(28)22-16)15-8-6-5-7-9-15/h5-13H,3-4H2,1-2H3,(H,22,28)/b16-12-