2-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoyl-methyl-amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoyl-methyl-amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetyl]-methyl-amino]-N-(p-tolyl)acetamide CAS Name: 2-[[2-[[4-(ethylamino)-2-quinazolinyl]thio]-1-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[[2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetyl]-methylamino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-[[4-(ethylamino)quinazolin-2-yl]thio]acetyl]-methyl-amino]-N-(p-tolyl)acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)N(C)CC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)N(C)CC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C22H25N5O2S/c1-4-23-21-17-7-5-6-8-18(17)25-22(26-21)30-14-20(29)27(3)13-19(28)24-16-11-9-15(2)10-12-16/h5-12H,4,13-14H2,1-3H3,(H,24,28)(H,23,25,26)