methyl 4-[[3-(3-morpholin-4-yl-3-oxidanylidene-propyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[[3-(3-morpholin-4-yl-3-oxidanylidene-propyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[[3-(3-morpholino-3-oxo-propyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[[3-[3-(4-morpholinyl)-3-oxopropyl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-morpholin-4-yl-3-oxopropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[[4-keto-3-(3-keto-3-morpholino-propyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid methyl ester Formula: C19H20N2O5S2 MolecularWeight: 420.5025

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)N3CCOCC3

InChI

InChI=1S/C19H20N2O5S2/c1-25-18(24)14-4-2-13(3-5-14)12-15-17(23)21(19(27)28-15)7-6-16(22)20-8-10-26-11-9-20/h2-5,12H,6-11H2,1H3