4-[(E)-[1-(3-methylphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzoate

Systemtic Name: 4-[(E)-[1-(3-methylphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzoate Openeye Name: 4-[(E)-[1-(m-tolyl)-5-oxo-2-thioxo-imidazolidin-4-ylidene]methyl]benzoate CAS Name: 4-[(E)-[1-(3-methylphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinylidene]methyl]benzoate IUPAC Name: 4-[(E)-[1-(3-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl]benzoate Traditional Name: 4-[(E)-[5-keto-1-(m-tolyl)-2-thioxo-imidazolidin-4-ylidene]methyl]benzoate Formula: C18H13N2O3S- MolecularWeight: 337.37242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])NC2=S

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)/C(=C\C3=CC=C(C=C3)C(=O)[O-])/NC2=S

InChI

InChI=1S/C18H14N2O3S/c1-11-3-2-4-14(9-11)20-16(21)15(19-18(20)24)10-12-5-7-13(8-6-12)17(22)23/h2-10H,1H3,(H,19,24)(H,22,23)/p-1/b15-10+