1-morpholin-4-yl-2-[4-(phenethylamino)quinazolin-2-yl]sulfanyl-butan-1-one

Systemtic Name: 1-morpholin-4-yl-2-[4-(phenethylamino)quinazolin-2-yl]sulfanyl-butan-1-one Openeye Name: 1-morpholino-2-[4-(phenethylamino)quinazolin-2-yl]sulfanyl-butan-1-one CAS Name: 1-(4-morpholinyl)-2-[[4-(phenethylamino)-2-quinazolinyl]thio]-1-butanone IUPAC Name: 1-morpholin-4-yl-2-[4-(phenethylamino)quinazolin-2-yl]sulfanylbutan-1-one Traditional Name: 1-morpholino-2-[[4-(phenethylamino)quinazolin-2-yl]thio]butan-1-one Formula: C24H28N4O2S MolecularWeight: 436.56972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCOCC1)SC2=NC3=CC=CC=C3C(=N2)NCCC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)N1CCOCC1)SC2=NC3=CC=CC=C3C(=N2)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2S/c1-2-21(23(29)28-14-16-30-17-15-28)31-24-26-20-11-7-6-10-19(20)22(27-24)25-13-12-18-8-4-3-5-9-18/h3-11,21H,2,12-17H2,1H3,(H,25,26,27)