N-(methylcarbamoyl)-2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(methylcarbamoyl)-2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(methylcarbamoyl)-2-[3-(7-methyloctyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(methylcarbamoyl)-2-[[3-(7-methyloctyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(methylcarbamoyl)-2-[3-(7-methyloctyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(7-methyloctyl)quinazolin-2-yl]thio]-N-(methylcarbamoyl)acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC

Isomeric SMILES

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC

InChI

InChI=1S/C21H30N4O3S/c1-15(2)10-6-4-5-9-13-25-19(27)16-11-7-8-12-17(16)23-21(25)29-14-18(26)24-20(28)22-3/h7-8,11-12,15H,4-6,9-10,13-14H2,1-3H3,(H2,22,24,26,28)