N-(1-adamantylcarbamoyl)-3-(7-fluoranyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-3-(7-fluoranyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(1-adamantylcarbamoyl)-3-(7-fluoro-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-3-(7-fluoro-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-3-(7-fluoro-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(1-adamantylcarbamoyl)-3-(7-fluoro-4-keto-quinazolin-3-yl)propionamide Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCN4C=NC5=C(C4=O)C=CC(=C5)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCN4C=NC5=C(C4=O)C=CC(=C5)F

InChI

InChI=1S/C22H25FN4O3/c23-16-1-2-17-18(8-16)24-12-27(20(17)29)4-3-19(28)25-21(30)26-22-9-13-5-14(10-22)7-15(6-13)11-22/h1-2,8,12-15H,3-7,9-11H2,(H2,25,26,28,30)