N-(1-adamantylmethyl)-2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(6,8-dichloro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(1-adamantylmethyl)-2-(6,8-dichloro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(6,8-dichloro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-(6,8-dichloro-4-keto-quinazolin-3-yl)acetamide Formula: C21H23Cl2N3O2 MolecularWeight: 420.33222

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CN4C=NC5=C(C=C(C=C5C4=O)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CN4C=NC5=C(C=C(C=C5C4=O)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O2/c22-15-4-16-19(17(23)5-15)25-11-26(20(16)28)9-18(27)24-10-21-6-12-1-13(7-21)3-14(2-12)8-21/h4-5,11-14H,1-3,6-10H2,(H,24,27)