3-(3,4-dimethylphenyl)-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethylphenyl)-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3,4-dimethylphenyl)-2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3,4-dimethylphenyl)-2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-4-quinazolinone IUPAC Name: 3-(3,4-dimethylphenyl)-2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanylquinazolin-4-one Traditional Name: 3-(3,4-dimethylphenyl)-2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]quinazolin-4-one Formula: C26H23FN2O2S MolecularWeight: 446.536423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C26H23FN2O2S/c1-17-9-14-21(16-18(17)2)29-25(31)22-6-3-4-7-23(22)28-26(29)32-15-5-8-24(30)19-10-12-20(27)13-11-19/h3-4,6-7,9-14,16H,5,8,15H2,1-2H3