N-[[3-[(4-fluorophenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-methylsulfanyl-benzamide

Systemtic Name: N-[[3-[(4-fluorophenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-methylsulfanyl-benzamide Openeye Name: N-[[3-[(4-fluorophenyl)methyl]-4,5-dihydroisoxazol-5-yl]methyl]-4-methylsulfanyl-benzamide CAS Name: N-[[3-[(4-fluorophenyl)methyl]-4,5-dihydroisoxazol-5-yl]methyl]-4-(methylthio)benzamide IUPAC Name: N-[[3-[(4-fluorophenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-methylsulfanylbenzamide Traditional Name: N-[[3-(4-fluorobenzyl)-2-isoxazolin-5-yl]methyl]-4-(methylthio)benzamide Formula: C19H19FN2O2S MolecularWeight: 358.429763

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NCC2CC(=NO2)CC3=CC=C(C=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NCC2CC(=NO2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2O2S/c1-25-18-8-4-14(5-9-18)19(23)21-12-17-11-16(22-24-17)10-13-2-6-15(20)7-3-13/h2-9,17H,10-12H2,1H3,(H,21,23)