4-[3-(1-adamantylcarbamoylamino)propanoylamino]-2-chloranyl-N,N-diethyl-benzamide

Systemtic Name: 4-[3-(1-adamantylcarbamoylamino)propanoylamino]-2-chloranyl-N,N-diethyl-benzamide Openeye Name: 4-[3-(1-adamantylcarbamoylamino)propanoylamino]-2-chloro-N,N-diethyl-benzamide CAS Name: 4-[[3-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropyl]amino]-2-chloro-N,N-diethylbenzamide IUPAC Name: 4-[3-(1-adamantylcarbamoylamino)propanoylamino]-2-chloro-N,N-diethylbenzamide Traditional Name: 4-[3-(1-adamantylcarbamoylamino)propanoylamino]-2-chloro-N,N-diethyl-benzamide Formula: C25H35ClN4O3 MolecularWeight: 475.0234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35ClN4O3/c1-3-30(4-2)23(32)20-6-5-19(12-21(20)26)28-22(31)7-8-27-24(33)29-25-13-16-9-17(14-25)11-18(10-16)15-25/h5-6,12,16-18H,3-4,7-11,13-15H2,1-2H3,(H,28,31)(H2,27,29,33)