4-[(2,5-dimethylphenyl)sulfanylmethyl]-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-[(2,5-dimethylphenyl)sulfanylmethyl]-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-[(2,5-dimethylphenyl)sulfanylmethyl]-3-fluoro-N'-hydroxy-benzamidine CAS Name: 4-[[(2,5-dimethylphenyl)thio]methyl]-3-fluoro-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-[(2,5-dimethylphenyl)sulfanylmethyl]-3-fluoro-N'-hydroxybenzenecarboximidamide Traditional Name: 4-[[(2,5-dimethylphenyl)thio]methyl]-3-fluoro-N'-hydroxy-benzamidine Formula: C16H17FN2OS MolecularWeight: 304.382383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC2=C(C=C(C=C2)C(=NO)N)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC2=C(C=C(C=C2)/C(=N/O)/N)F

InChI

InChI=1S/C16H17FN2OS/c1-10-3-4-11(2)15(7-10)21-9-13-6-5-12(8-14(13)17)16(18)19-20/h3-8,20H,9H2,1-2H3,(H2,18,19)