2-[[2-(trifluoromethyl)phenyl]methylsulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[2-(trifluoromethyl)phenyl]methylsulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[2-(trifluoromethyl)phenyl]methylsulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[2-(trifluoromethyl)phenyl]methylthio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[2-(trifluoromethyl)phenyl]methylsulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-(trifluoromethyl)benzyl]thio]methyl]-1H-quinazolin-4-one Formula: C17H13F3N2OS MolecularWeight: 350.35813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC2=NC(=O)C3=CC=CC=C3N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCC2=NC(=O)C3=CC=CC=C3N2)C(F)(F)F

InChI

InChI=1S/C17H13F3N2OS/c18-17(19,20)13-7-3-1-5-11(13)9-24-10-15-21-14-8-4-2-6-12(14)16(23)22-15/h1-8H,9-10H2,(H,21,22,23)