(3-sulfanylcyclohexyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carboxylate

Systemtic Name: (3-sulfanylcyclohexyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carboxylate Openeye Name: (3-sulfanylcyclohexyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)thiazole-4-carboxylate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-thiazolecarboxylic acid (3-mercaptocyclohexyl) ester IUPAC Name: (3-sulfanylcyclohexyl) 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)thiazole-4-carboxylic acid (3-mercaptocyclohexyl) ester Formula: C18H19NO4S2 MolecularWeight: 377.47776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)S)OC(=O)C2=CSC(=N2)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CC(CC(C1)S)OC(=O)C2=CSC(=N2)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C18H19NO4S2/c20-18(22-11-4-3-5-12(24)8-11)13-10-25-17(19-13)16-9-21-14-6-1-2-7-15(14)23-16/h1-2,6-7,10-12,16,24H,3-5,8-9H2