3-(1-adamantylcarbamoylamino)-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]propanamide

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]propanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]propanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-[1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]propionamide Formula: C24H32N4O4 MolecularWeight: 440.53528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32N4O4/c1-14(18-2-3-20-19(9-18)27-22(30)13-32-20)26-21(29)4-5-25-23(31)28-24-10-15-6-16(11-24)8-17(7-15)12-24/h2-3,9,14-17H,4-8,10-13H2,1H3,(H,26,29)(H,27,30)(H2,25,28,31)