N-[4-[[1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl]amino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[[1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl]amino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[1-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropan-2-yl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[1-(1-adamantylcarbamoylamino)-1-oxopropan-2-yl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-(1-adamantylcarbamoylamino)-2-keto-1-methyl-ethyl]amino]phenyl]-3-methyl-butyramide Formula: C25H36N4O3 MolecularWeight: 440.57834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H36N4O3/c1-15(2)8-22(30)27-21-6-4-20(5-7-21)26-16(3)23(31)28-24(32)29-25-12-17-9-18(13-25)11-19(10-17)14-25/h4-7,15-19,26H,8-14H2,1-3H3,(H,27,30)(H2,28,29,31,32)