7-chloranyl-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one Openeye Name: 7-chloro-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one CAS Name: 7-chloro-3-(3,5-dimethylphenyl)-2-[[(4-fluorophenyl)thio]methyl]-4-quinazolinone IUPAC Name: 7-chloro-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one Traditional Name: 7-chloro-3-(3,5-dimethylphenyl)-2-[[(4-fluorophenyl)thio]methyl]quinazolin-4-one Formula: C23H18ClFN2OS MolecularWeight: 424.918223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NC3=C(C2=O)C=CC(=C3)Cl)CSC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NC3=C(C2=O)C=CC(=C3)Cl)CSC4=CC=C(C=C4)F)C

InChI

InChI=1S/C23H18ClFN2OS/c1-14-9-15(2)11-18(10-14)27-22(13-29-19-6-4-17(25)5-7-19)26-21-12-16(24)3-8-20(21)23(27)28/h3-12H,13H2,1-2H3