2-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one Openeye Name: 2-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one CAS Name: 2-[2-(2,5-dimethylphenyl)sulfonylethylthio]-3-(2-fluorophenyl)-4-quinazolinone IUPAC Name: 2-[2-(2,5-dimethylphenyl)sulfonylethylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one Traditional Name: 2-[2-(2,5-dimethylphenyl)sulfonylethylthio]-3-(2-fluorophenyl)quinazolin-4-one Formula: C24H21FN2O3S2 MolecularWeight: 468.563543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4F

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4F

InChI

InChI=1S/C24H21FN2O3S2/c1-16-11-12-17(2)22(15-16)32(29,30)14-13-31-24-26-20-9-5-3-7-18(20)23(28)27(24)21-10-6-4-8-19(21)25/h3-12,15H,13-14H2,1-2H3