N-(1-adamantylcarbamothioyl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: N-(1-adamantylcarbamothioyl)-2-(2-isopropyl-5-methyl-phenoxy)acetamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-(1-adamantylcarbamothioyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: N-(1-adamantylthiocarbamoyl)-2-(2-isopropyl-5-methyl-phenoxy)acetamide Formula: C23H32N2O2S MolecularWeight: 400.57738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O2S/c1-14(2)19-5-4-15(3)6-20(19)27-13-21(26)24-22(28)25-23-10-16-7-17(11-23)9-18(8-16)12-23/h4-6,14,16-18H,7-13H2,1-3H3,(H2,24,25,26,28)