butyl 4-[4-[(5Z)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate

Systemtic Name: butyl 4-[4-[(5Z)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate Openeye Name: butyl 4-[4-[(5Z)-5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl]butanoylamino]benzoate CAS Name: 4-[[1-oxo-4-[(5Z)-4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]butyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[4-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoate Traditional Name: 4-[4-[(5Z)-5-benzal-4-keto-2-thioxo-thiazolidin-3-yl]butanoylamino]benzoic acid butyl ester Formula: C25H26N2O4S2 MolecularWeight: 482.61494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN2C(=O)/C(=C/C3=CC=CC=C3)/SC2=S

InChI

InChI=1S/C25H26N2O4S2/c1-2-3-16-31-24(30)19-11-13-20(14-12-19)26-22(28)10-7-15-27-23(29)21(33-25(27)32)17-18-8-5-4-6-9-18/h4-6,8-9,11-14,17H,2-3,7,10,15-16H2,1H3,(H,26,28)/b21-17-