4-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]-N,N-dimethyl-benzamide Openeye Name: 4-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]-N,N-dimethyl-benzamide CAS Name: 4-[[[3-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropyl]amino]methyl]-N,N-dimethylbenzamide IUPAC Name: 4-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]-N,N-dimethylbenzamide Traditional Name: 4-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]-N,N-dimethyl-benzamide Formula: C24H34N4O3 MolecularWeight: 426.55176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H34N4O3/c1-28(2)22(30)20-5-3-16(4-6-20)15-26-21(29)7-8-25-23(31)27-24-12-17-9-18(13-24)11-19(10-17)14-24/h3-6,17-19H,7-15H2,1-2H3,(H,26,29)(H2,25,27,31)