N-[3-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[3-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[3-(1-adamantylcarbamoylamino)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N4O3/c30-22(27-15-16-2-1-3-21(11-16)28-23(31)20-4-5-20)6-7-26-24(32)29-25-12-17-8-18(13-25)10-19(9-17)14-25/h1-3,11,17-20H,4-10,12-15H2,(H,27,30)(H,28,31)(H2,26,29,32)