[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C22H19NO3S2 MolecularWeight: 409.52116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)COC(=O)C3=CC=CC=C3SCC4=CSC=N4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)COC(=O)C3=CC=CC=C3SCC4=CSC=N4

InChI

InChI=1S/C22H19NO3S2/c24-20(17-9-8-15-4-3-5-16(15)10-17)11-26-22(25)19-6-1-2-7-21(19)28-13-18-12-27-14-23-18/h1-2,6-10,12,14H,3-5,11,13H2