N-(1-adamantyl)-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-ethyl-propanamide

Systemtic Name: N-(1-adamantyl)-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-ethyl-propanamide Openeye Name: N-(1-adamantyl)-3-(6-bromo-4-oxo-quinazolin-3-yl)-N-ethyl-propanamide CAS Name: N-(1-adamantyl)-3-(6-bromo-4-oxo-3-quinazolinyl)-N-ethylpropanamide IUPAC Name: N-(1-adamantyl)-3-(6-bromo-4-oxoquinazolin-3-yl)-N-ethylpropanamide Traditional Name: N-(1-adamantyl)-3-(6-bromo-4-keto-quinazolin-3-yl)-N-ethyl-propionamide Formula: C23H28BrN3O2 MolecularWeight: 458.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)CCN1C=NC2=C(C1=O)C=C(C=C2)Br)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN(C(=O)CCN1C=NC2=C(C1=O)C=C(C=C2)Br)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H28BrN3O2/c1-2-27(23-11-15-7-16(12-23)9-17(8-15)13-23)21(28)5-6-26-14-25-20-4-3-18(24)10-19(20)22(26)29/h3-4,10,14-17H,2,5-9,11-13H2,1H3