N-(2-adamantyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-adamantyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-adamantyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2-adamantyl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2-adamantyl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(2-adamantyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H25N3O2S/c1-24-20(26)16-4-2-3-5-17(16)22-21(24)27-11-18(25)23-19-14-7-12-6-13(9-14)10-15(19)8-12/h2-5,12-15,19H,6-11H2,1H3,(H,23,25)