(3-fluorophenyl)methyl N'-tert-butylcarbamimidothioate

Systemtic Name: (3-fluorophenyl)methyl N'-tert-butylcarbamimidothioate Openeye Name: 3-tert-butyl-2-[(3-fluorophenyl)methyl]isothiourea CAS Name: N'-tert-butylcarbamimidothioic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl N'-tert-butylcarbamimidothioate Traditional Name: 3-tert-butyl-2-(3-fluorobenzyl)isothiourea Formula: C12H17FN2S MolecularWeight: 240.340183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(N)SCC1=CC(=CC=C1)F

Isomeric SMILES

CC(C)(C)N=C(N)SCC1=CC(=CC=C1)F

InChI

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