4-fluoranyl-3-[(2-methylpropan-2-yl)oxymethyl]benzenecarbothioamide

Systemtic Name: 4-fluoranyl-3-[(2-methylpropan-2-yl)oxymethyl]benzenecarbothioamide Openeye Name: 3-(tert-butoxymethyl)-4-fluoro-benzenecarbothioamide CAS Name: 4-fluoro-3-[(2-methylpropan-2-yl)oxymethyl]benzenecarbothioamide IUPAC Name: 4-fluoro-3-[(2-methylpropan-2-yl)oxymethyl]benzenecarbothioamide Traditional Name: 3-(tert-butoxymethyl)-4-fluoro-thiobenzamide Formula: C12H16FNOS MolecularWeight: 241.324943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OCC1=C(C=CC(=C1)C(=S)N)F

Isomeric SMILES

CC(C)(C)OCC1=C(C=CC(=C1)C(=S)N)F

InChI

InChI=1S/C12H16FNOS/c1-12(2,3)15-7-9-6-8(11(14)16)4-5-10(9)13/h4-6H,7H2,1-3H3,(H2,14,16)