ethyl 4-[6-[(5Z)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]hexanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-[(5Z)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]hexanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[6-[(5Z)-4-oxo-5-(2-thienylmethylene)-2-thioxo-thiazolidin-3-yl]hexanoyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]hexyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]hexanoyl]piperazine-1-carboxylate Traditional Name: 4-[6-[(5Z)-4-keto-5-(2-thenylidene)-2-thioxo-thiazolidin-3-yl]hexanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H27N3O4S3 MolecularWeight: 481.65178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCCCCN2C(=O)C(=CC3=CC=CS3)SC2=S

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCCCCN2C(=O)/C(=C/C3=CC=CS3)/SC2=S

InChI

InChI=1S/C21H27N3O4S3/c1-2-28-20(27)23-12-10-22(11-13-23)18(25)8-4-3-5-9-24-19(26)17(31-21(24)29)15-16-7-6-14-30-16/h6-7,14-15H,2-5,8-13H2,1H3/b17-15-