2-[1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-[1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-2-[2-oxo-1,2-bis(p-tolyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[1,2-bis(4-methylphenyl)-2-oxoethyl]thio]-3-(4-fluorophenyl)-4-quinazolinone IUPAC Name: 2-[1,2-bis(4-methylphenyl)-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 3-(4-fluorophenyl)-2-[[2-keto-1,2-bis(p-tolyl)ethyl]thio]quinazolin-4-one Formula: C30H23FN2O2S MolecularWeight: 494.579223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

InChI

InChI=1S/C30H23FN2O2S/c1-19-7-11-21(12-8-19)27(34)28(22-13-9-20(2)10-14-22)36-30-32-26-6-4-3-5-25(26)29(35)33(30)24-17-15-23(31)16-18-24/h3-18,28H,1-2H3