2-(2-dimethylaminoethylsulfanyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 2-(2-dimethylaminoethylthio)-3-[3-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 2-(2-dimethylaminoethylthio)-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C19H18F3N3OS MolecularWeight: 393.42593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CN(C)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3N3OS/c1-24(2)10-11-27-18-23-16-9-4-3-8-15(16)17(26)25(18)14-7-5-6-13(12-14)19(20,21)22/h3-9,12H,10-11H2,1-2H3