4-(butylsulfanylmethyl)-3-fluoranyl-benzenecarboximidamide

Systemtic Name: 4-(butylsulfanylmethyl)-3-fluoranyl-benzenecarboximidamide Openeye Name: 4-(butylsulfanylmethyl)-3-fluoro-benzamidine CAS Name: 4-[(butylthio)methyl]-3-fluorobenzenecarboximidamide IUPAC Name: 4-(butylsulfanylmethyl)-3-fluorobenzenecarboximidamide Traditional Name: 4-[(butylthio)methyl]-3-fluoro-benzamidine Formula: C12H17FN2S MolecularWeight: 240.340183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1=C(C=C(C=C1)C(=N)N)F

Isomeric SMILES

CCCCSCC1=C(C=C(C=C1)C(=N)N)F

InChI

InChI=1S/C12H17FN2S/c1-2-3-6-16-8-10-5-4-9(12(14)15)7-11(10)13/h4-5,7H,2-3,6,8H2,1H3,(H3,14,15)