3-fluoranyl-4-(3-methylbutylamino)benzenecarbothioamide

Systemtic Name: 3-fluoranyl-4-(3-methylbutylamino)benzenecarbothioamide Openeye Name: 3-fluoro-4-(isopentylamino)benzenecarbothioamide CAS Name: 3-fluoro-4-(3-methylbutylamino)benzenecarbothioamide IUPAC Name: 3-fluoro-4-(3-methylbutylamino)benzenecarbothioamide Traditional Name: 3-fluoro-4-(isoamylamino)thiobenzamide Formula: C12H17FN2S MolecularWeight: 240.340183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C=C(C=C1)C(=S)N)F

Isomeric SMILES

CC(C)CCNC1=C(C=C(C=C1)C(=S)N)F

InChI

InChI=1S/C12H17FN2S/c1-8(2)5-6-15-11-4-3-9(12(14)16)7-10(11)13/h3-4,7-8,15H,5-6H2,1-2H3,(H2,14,16)