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

Systemtic Name: N-(1-adamantylmethyl)-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(1-adamantylmethyl)-3-(6-bromo-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-(1-adamantylmethyl)-3-(6-bromo-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(1-adamantylmethyl)-3-(6-bromo-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(1-adamantylmethyl)-3-(6-bromo-4-keto-quinazolin-3-yl)propionamide Formula: C22H26BrN3O2 MolecularWeight: 444.36474

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CCN4C=NC5=C(C4=O)C=C(C=C5)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CCN4C=NC5=C(C4=O)C=C(C=C5)Br

InChI

InChI=1S/C22H26BrN3O2/c23-17-1-2-19-18(8-17)21(28)26(13-25-19)4-3-20(27)24-12-22-9-14-5-15(10-22)7-16(6-14)11-22/h1-2,8,13-16H,3-7,9-12H2,(H,24,27)