6-bromanyl-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one Openeye Name: 6-bromo-2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one CAS Name: 6-bromo-2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-3-(1-phenylethyl)-4-quinazolinone IUPAC Name: 6-bromo-2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-3-(1-phenylethyl)quinazolin-4-one Traditional Name: 6-bromo-2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-3-(1-phenylethyl)quinazolin-4-one Formula: C26H22BrFN2O2S MolecularWeight: 525.432483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=C(C=CC(=C3)Br)N=C2SCCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=C(C=CC(=C3)Br)N=C2SCCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H22BrFN2O2S/c1-17(18-6-3-2-4-7-18)30-25(32)22-16-20(27)11-14-23(22)29-26(30)33-15-5-8-24(31)19-9-12-21(28)13-10-19/h2-4,6-7,9-14,16-17H,5,8,15H2,1H3