N-(4-ethoxyphenyl)-2-[4-(2-methoxyethylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[4-(2-methoxyethylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[4-(2-methoxyethylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[4-(2-methoxyethylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[4-(2-methoxyethylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-(2-methoxyethylamino)quinazolin-2-yl]thio]-N-p-phenetyl-acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NCCOC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NCCOC

InChI

InChI=1S/C21H24N4O3S/c1-3-28-16-10-8-15(9-11-16)23-19(26)14-29-21-24-18-7-5-4-6-17(18)20(25-21)22-12-13-27-2/h4-11H,3,12-14H2,1-2H3,(H,23,26)(H,22,24,25)