N-(1-adamantylmethyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]acetamide Formula: C24H31N3O3S MolecularWeight: 441.58624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H31N3O3S/c1-30-7-6-27-22(29)19-4-2-3-5-20(19)26-23(27)31-14-21(28)25-15-24-11-16-8-17(12-24)10-18(9-16)13-24/h2-5,16-18H,6-15H2,1H3,(H,25,28)