2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(2-chloro-6-fluorophenyl)methylthio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)thio]methyl]-1H-quinazolin-4-one Formula: C16H12ClFN2OS MolecularWeight: 334.795683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H12ClFN2OS/c17-12-5-3-6-13(18)11(12)8-22-9-15-19-14-7-2-1-4-10(14)16(21)20-15/h1-7H,8-9H2,(H,19,20,21)