2-[2-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-benzo[g]quinazolin-4-one

Systemtic Name: 2-[2-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-benzo[g]quinazolin-4-one Openeye Name: 2-[2-(3-fluoro-4-methoxy-phenyl)-2-oxo-ethyl]sulfanyl-3-methyl-benzo[g]quinazolin-4-one CAS Name: 2-[[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]thio]-3-methyl-4-benzo[g]quinazolinone IUPAC Name: 2-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]sulfanyl-3-methylbenzo[g]quinazolin-4-one Traditional Name: 2-[[2-(3-fluoro-4-methoxy-phenyl)-2-keto-ethyl]thio]-3-methyl-benzo[g]quinazolin-4-one Formula: C22H17FN2O3S MolecularWeight: 408.445383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)C4=CC(=C(C=C4)OC)F

Isomeric SMILES

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)C4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C22H17FN2O3S/c1-25-21(27)16-9-13-5-3-4-6-14(13)11-18(16)24-22(25)29-12-19(26)15-7-8-20(28-2)17(23)10-15/h3-11H,12H2,1-2H3