3-fluoranyl-4-[[methyl(pentan-2-yl)amino]methyl]benzenecarbothioamide

Systemtic Name: 3-fluoranyl-4-[[methyl(pentan-2-yl)amino]methyl]benzenecarbothioamide Openeye Name: 3-fluoro-4-[[methyl(1-methylbutyl)amino]methyl]benzenecarbothioamide CAS Name: 3-fluoro-4-[[methyl(pentan-2-yl)amino]methyl]benzenecarbothioamide IUPAC Name: 3-fluoro-4-[[methyl(pentan-2-yl)amino]methyl]benzenecarbothioamide Traditional Name: 3-fluoro-4-[[methyl(1-methylbutyl)amino]methyl]thiobenzamide Formula: C14H21FN2S MolecularWeight: 268.393343

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N(C)CC1=C(C=C(C=C1)C(=S)N)F

Isomeric SMILES

CCCC(C)N(C)CC1=C(C=C(C=C1)C(=S)N)F

InChI

InChI=1S/C14H21FN2S/c1-4-5-10(2)17(3)9-12-7-6-11(14(16)18)8-13(12)15/h6-8,10H,4-5,9H2,1-3H3,(H2,16,18)