4-(2,2-dimethylpropyl)-8-fluoranyl-2-methylsulfanyl-quinoline

Systemtic Name: 4-(2,2-dimethylpropyl)-8-fluoranyl-2-methylsulfanyl-quinoline Openeye Name: 4-(2,2-dimethylpropyl)-8-fluoro-2-methylsulfanyl-quinoline CAS Name: 4-(2,2-dimethylpropyl)-8-fluoro-2-(methylthio)quinoline IUPAC Name: 4-(2,2-dimethylpropyl)-8-fluoro-2-methylsulfanylquinoline Traditional Name: 8-fluoro-2-(methylthio)-4-neopentyl-quinoline Formula: C15H18FNS MolecularWeight: 263.373523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC(=NC2=C1C=CC=C2F)SC

Isomeric SMILES

CC(C)(C)CC1=CC(=NC2=C1C=CC=C2F)SC

InChI

InChI=1S/C15H18FNS/c1-15(2,3)9-10-8-13(18-4)17-14-11(10)6-5-7-12(14)16/h5-8H,9H2,1-4H3