ethyl 2-[(4E)-3-methyl-5-oxidanylidene-4-(pyridin-4-ylmethylidene)-2-sulfanylidene-imidazolidin-1-yl]benzoate

Systemtic Name: ethyl 2-[(4E)-3-methyl-5-oxidanylidene-4-(pyridin-4-ylmethylidene)-2-sulfanylidene-imidazolidin-1-yl]benzoate Openeye Name: ethyl 2-[(4E)-3-methyl-5-oxo-4-(4-pyridylmethylene)-2-thioxo-imidazolidin-1-yl]benzoate CAS Name: 2-[(4E)-3-methyl-5-oxo-4-(pyridin-4-ylmethylidene)-2-sulfanylidene-1-imidazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(4E)-3-methyl-5-oxo-4-(pyridin-4-ylmethylidene)-2-sulfanylideneimidazolidin-1-yl]benzoate Traditional Name: 2-[(4E)-5-keto-3-methyl-4-(4-pyridylmethylene)-2-thioxo-imidazolidin-1-yl]benzoic acid ethyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1N2C(=O)C(=CC3=CC=NC=C3)N(C2=S)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1N2C(=O)/C(=C\C3=CC=NC=C3)/N(C2=S)C

InChI

InChI=1S/C19H17N3O3S/c1-3-25-18(24)14-6-4-5-7-15(14)22-17(23)16(21(2)19(22)26)12-13-8-10-20-11-9-13/h4-12H,3H2,1-2H3/b16-12+