4-fluoranyl-3-(2-methylpropoxymethyl)benzenecarbothioamide

Systemtic Name: 4-fluoranyl-3-(2-methylpropoxymethyl)benzenecarbothioamide Openeye Name: 4-fluoro-3-(isobutoxymethyl)benzenecarbothioamide CAS Name: 4-fluoro-3-(2-methylpropoxymethyl)benzenecarbothioamide IUPAC Name: 4-fluoro-3-(2-methylpropoxymethyl)benzenecarbothioamide Traditional Name: 4-fluoro-3-(isobutoxymethyl)thiobenzamide Formula: C12H16FNOS MolecularWeight: 241.324943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC1=C(C=CC(=C1)C(=S)N)F

Isomeric SMILES

CC(C)COCC1=C(C=CC(=C1)C(=S)N)F

InChI

InChI=1S/C12H16FNOS/c1-8(2)6-15-7-10-5-9(12(14)16)3-4-11(10)13/h3-5,8H,6-7H2,1-2H3,(H2,14,16)