N-(1-adamantylcarbamoyl)-2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]propionamide Formula: C24H31N5O3 MolecularWeight: 437.53464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N(C)CC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N(C)CC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C24H31N5O3/c1-14(29(2)13-20-25-19-6-4-3-5-18(19)22(31)26-20)21(30)27-23(32)28-24-10-15-7-16(11-24)9-17(8-15)12-24/h3-6,14-17H,7-13H2,1-2H3,(H,25,26,31)(H2,27,28,30,32)