N-[[4-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-carbamoyl]benzyl]adamantane-1-carboxamide Formula: C29H32N4O3 MolecularWeight: 484.58938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H32N4O3/c1-33(17-25-31-24-5-3-2-4-23(24)26(34)32-25)27(35)22-8-6-18(7-9-22)16-30-28(36)29-13-19-10-20(14-29)12-21(11-19)15-29/h2-9,19-21H,10-17H2,1H3,(H,30,36)(H,31,32,34)