2-diethylaminoethyl 4-[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[3-[(5E)-5-[(4-methoxyphenyl)methylene]-2-oxo-4-thioxo-thiazolidin-3-yl]propanoylamino]benzoate CAS Name: 4-[[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxo-4-sulfanylidene-3-thiazolidinyl]-1-oxopropyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoate Traditional Name: 4-[3-[(5E)-2-keto-5-p-anisylidene-4-thioxo-thiazolidin-3-yl]propanoylamino]benzoic acid 2-diethylaminoethyl ester Formula: C27H31N3O5S2 MolecularWeight: 541.68214

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=S)C(=CC3=CC=C(C=C3)OC)SC2=O

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=S)/C(=C\C3=CC=C(C=C3)OC)/SC2=O

InChI

InChI=1S/C27H31N3O5S2/c1-4-29(5-2)16-17-35-26(32)20-8-10-21(11-9-20)28-24(31)14-15-30-25(36)23(37-27(30)33)18-19-6-12-22(34-3)13-7-19/h6-13,18H,4-5,14-17H2,1-3H3,(H,28,31)/b23-18+