1-[2,4-bis(oxidanyl)phenyl]-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[2,4-bis(oxidanyl)phenyl]-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 1-(2,4-dihydroxyphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanone CAS Name: 1-(2,4-dihydroxyphenyl)-2-[[4-(ethylamino)-2-quinazolinyl]thio]ethanone IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanone Traditional Name: 1-(2,4-dihydroxyphenyl)-2-[[4-(ethylamino)quinazolin-2-yl]thio]ethanone Formula: C18H17N3O3S MolecularWeight: 355.41088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O3S/c1-2-19-17-12-5-3-4-6-14(12)20-18(21-17)25-10-16(24)13-8-7-11(22)9-15(13)23/h3-9,22-23H,2,10H2,1H3,(H,19,20,21)