[2-(1-adamantyl)-2-oxidanylidene-ethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 3-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 3-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 3-[(2-methylthiazol-4-yl)methoxy]benzoic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C24H27NO4S MolecularWeight: 425.54048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OCC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)OCC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H27NO4S/c1-15-25-20(14-30-15)12-28-21-4-2-3-19(8-21)23(27)29-13-22(26)24-9-16-5-17(10-24)7-18(6-16)11-24/h2-4,8,14,16-18H,5-7,9-13H2,1H3