ethyl 4-[2,5-dimethyl-3-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[2,5-dimethyl-3-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[2,5-dimethyl-3-[(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]pyrrol-1-yl]benzoate CAS Name: 4-[2,5-dimethyl-3-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,5-dimethyl-3-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]pyrrol-1-yl]benzoate Traditional Name: 4-[3-[(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=S)N3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=S)N3)C

InChI

InChI=1S/C19H19N3O3S/c1-4-25-18(24)13-5-7-15(8-6-13)22-11(2)9-14(12(22)3)10-16-17(23)21-19(26)20-16/h5-10H,4H2,1-3H3,(H2,20,21,23,26)