3-[3-(1-adamantylcarbamoylamino)propanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[3-(1-adamantylcarbamoylamino)propanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[3-(1-adamantylcarbamoylamino)propanoylamino]-N,N-diethyl-benzamide CAS Name: 3-[[3-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[3-(1-adamantylcarbamoylamino)propanoylamino]-N,N-diethylbenzamide Traditional Name: 3-[3-(1-adamantylcarbamoylamino)propanoylamino]-N,N-diethyl-benzamide Formula: C25H36N4O3 MolecularWeight: 440.57834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H36N4O3/c1-3-29(4-2)23(31)20-6-5-7-21(13-20)27-22(30)8-9-26-24(32)28-25-14-17-10-18(15-25)12-19(11-17)16-25/h5-7,13,17-19H,3-4,8-12,14-16H2,1-2H3,(H,27,30)(H2,26,28,32)