butyl 4-[6-[(5Z)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]hexanoylamino]benzoate

Systemtic Name: butyl 4-[6-[(5Z)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]hexanoylamino]benzoate Openeye Name: butyl 4-[6-[(5Z)-4-oxo-5-(2-thienylmethylene)-2-thioxo-thiazolidin-3-yl]hexanoylamino]benzoate CAS Name: 4-[[1-oxo-6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]hexyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]hexanoylamino]benzoate Traditional Name: 4-[6-[(5Z)-4-keto-5-(2-thenylidene)-2-thioxo-thiazolidin-3-yl]hexanoylamino]benzoic acid butyl ester Formula: C25H28N2O4S3 MolecularWeight: 516.69582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C(=CC3=CC=CS3)SC2=S

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)/C(=C/C3=CC=CS3)/SC2=S

InChI

InChI=1S/C25H28N2O4S3/c1-2-3-15-31-24(30)18-10-12-19(13-11-18)26-22(28)9-5-4-6-14-27-23(29)21(34-25(27)32)17-20-8-7-16-33-20/h7-8,10-13,16-17H,2-6,9,14-15H2,1H3,(H,26,28)/b21-17-