2-(pentylamino)-5-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 2-(pentylamino)-5-(trifluoromethyl)benzenecarbothioamide Openeye Name: 2-(pentylamino)-5-(trifluoromethyl)benzenecarbothioamide CAS Name: 2-(pentylamino)-5-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 2-(pentylamino)-5-(trifluoromethyl)benzenecarbothioamide Traditional Name: 2-(amylamino)-5-(trifluoromethyl)thiobenzamide Formula: C13H17F3N2S MolecularWeight: 290.34769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1)C(F)(F)F)C(=S)N

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1)C(F)(F)F)C(=S)N

InChI

InChI=1S/C13H17F3N2S/c1-2-3-4-7-18-11-6-5-9(13(14,15)16)8-10(11)12(17)19/h5-6,8,18H,2-4,7H2,1H3,(H2,17,19)