7-thiomorpholin-4-ylcarbonyl-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 7-thiomorpholin-4-ylcarbonyl-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 7-(thiomorpholine-4-carbonyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 7-[oxo(thiomorpholin-4-yl)methyl]-3-[3-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 7-(thiomorpholine-4-carbonyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 7-(thiomorpholine-4-carbonyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C20H16F3N3O2S MolecularWeight: 419.42015

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C=N3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CSCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C=N3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H16F3N3O2S/c21-20(22,23)14-2-1-3-15(11-14)26-12-24-17-10-13(4-5-16(17)19(26)28)18(27)25-6-8-29-9-7-25/h1-5,10-12H,6-9H2