N-[1-(1-adamantyl)ethyl]-2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-[3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-[[3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-[3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[[3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C27H37N3O3S MolecularWeight: 483.66598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H37N3O3S/c1-3-33-10-6-9-30-25(32)22-7-4-5-8-23(22)29-26(30)34-17-24(31)28-18(2)27-14-19-11-20(15-27)13-21(12-19)16-27/h4-5,7-8,18-21H,3,6,9-17H2,1-2H3,(H,28,31)