N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-4-isopropoxy-benzamide CAS Name: N-[[[(1R)-1-(1-adamantyl)ethyl]amino]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: N-[[(1R)-1-(1-adamantyl)ethyl]thiocarbamoyl]-4-isopropoxy-benzamide Formula: C23H32N2O2S MolecularWeight: 400.57738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CC=C(C=C4)OC(C)C

InChI

InChI=1S/C23H32N2O2S/c1-14(2)27-20-6-4-19(5-7-20)21(26)25-22(28)24-15(3)23-11-16-8-17(12-23)10-18(9-16)13-23/h4-7,14-18H,8-13H2,1-3H3,(H2,24,25,26,28)/t15-,16?,17?,18?,23?/m1/s1