N-(1-adamantylcarbamoyl)-3-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-3-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(1-adamantylcarbamoyl)-3-(6-chloro-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-3-(6-chloro-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-3-(6-chloro-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(1-adamantylcarbamoyl)-3-(6-chloro-4-keto-quinazolin-3-yl)propionamide Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN4O3/c23-16-1-2-18-17(8-16)20(29)27(12-24-18)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)