2-diethylaminoethyl 4-[4-[(5E)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[4-[(5E)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[4-[(5E)-4-oxo-5-(2-thienylmethylene)-2-thioxo-thiazolidin-3-yl]butanoylamino]benzoate CAS Name: 4-[[1-oxo-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]butyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoylamino]benzoate Traditional Name: 4-[4-[(5E)-4-keto-5-(2-thenylidene)-2-thioxo-thiazolidin-3-yl]butanoylamino]benzoic acid 2-diethylaminoethyl ester Formula: C25H29N3O4S3 MolecularWeight: 531.71046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN2C(=O)/C(=C\C3=CC=CS3)/SC2=S

InChI

InChI=1S/C25H29N3O4S3/c1-3-27(4-2)14-15-32-24(31)18-9-11-19(12-10-18)26-22(29)8-5-13-28-23(30)21(35-25(28)33)17-20-7-6-16-34-20/h6-7,9-12,16-17H,3-5,8,13-15H2,1-2H3,(H,26,29)/b21-17+