2-[(4-tert-butylphenyl)methylsulfanyl]-3-(3-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(3-fluorophenyl)quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(3-fluorophenyl)quinazolin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-(3-fluorophenyl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(3-fluorophenyl)quinazolin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-3-(3-fluorophenyl)quinazolin-4-one Formula: C25H23FN2OS MolecularWeight: 418.526323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)F

InChI

InChI=1S/C25H23FN2OS/c1-25(2,3)18-13-11-17(12-14-18)16-30-24-27-22-10-5-4-9-21(22)23(29)28(24)20-8-6-7-19(26)15-20/h4-15H,16H2,1-3H3