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

Systemtic Name: [2-methoxy-4-[(Z)-[1-(2-methylphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]phenyl] propanoate Openeye Name: [2-methoxy-4-[(Z)-[1-(o-tolyl)-5-oxo-2-thioxo-imidazolidin-4-ylidene]methyl]phenyl] propanoate CAS Name: propanoic acid [2-methoxy-4-[(Z)-[1-(2-methylphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-[1-(2-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl]phenyl] propanoate Traditional Name: propionic acid [4-[(Z)-[5-keto-1-(o-tolyl)-2-thioxo-imidazolidin-4-ylidene]methyl]-2-methoxy-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=C3C)OC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=S)N2)C3=CC=CC=C3C)OC

InChI

InChI=1S/C21H20N2O4S/c1-4-19(24)27-17-10-9-14(12-18(17)26-3)11-15-20(25)23(21(28)22-15)16-8-6-5-7-13(16)2/h5-12H,4H2,1-3H3,(H,22,28)/b15-11-