3-[2,5-bis(trifluoromethyl)phenyl]-2-ethylsulfanyl-quinazolin-4-one

Systemtic Name: 3-[2,5-bis(trifluoromethyl)phenyl]-2-ethylsulfanyl-quinazolin-4-one Openeye Name: 3-[2,5-bis(trifluoromethyl)phenyl]-2-ethylsulfanyl-quinazolin-4-one CAS Name: 3-[2,5-bis(trifluoromethyl)phenyl]-2-(ethylthio)-4-quinazolinone IUPAC Name: 3-[2,5-bis(trifluoromethyl)phenyl]-2-ethylsulfanylquinazolin-4-one Traditional Name: 3-[2,5-bis(trifluoromethyl)phenyl]-2-(ethylthio)quinazolin-4-one Formula: C18H12F6N2OS MolecularWeight: 418.356099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12F6N2OS/c1-2-28-16-25-13-6-4-3-5-11(13)15(27)26(16)14-9-10(17(19,20)21)7-8-12(14)18(22,23)24/h3-9H,2H2,1H3