1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C24H30N4O4 MolecularWeight: 438.5194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H30N4O4/c1-14(21-26-19-5-3-2-4-18(19)22(30)27-21)32-20(29)6-7-25-23(31)28-24-11-15-8-16(12-24)10-17(9-15)13-24/h2-5,14-17H,6-13H2,1H3,(H2,25,28,31)(H,26,27,30)