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

Systemtic Name: N-(1-adamantyl)-2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: N-(1-adamantyl)-2-(6,8-dichloro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(1-adamantyl)-2-(6,8-dichloro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(1-adamantyl)-2-(6,8-dichloro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(1-adamantyl)-2-(6,8-dichloro-4-keto-quinazolin-3-yl)acetamide Formula: C20H21Cl2N3O2 MolecularWeight: 406.30564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21Cl2N3O2/c21-14-4-15-18(16(22)5-14)23-10-25(19(15)27)9-17(26)24-20-6-11-1-12(7-20)3-13(2-11)8-20/h4-5,10-13H,1-3,6-9H2,(H,24,26)