N-[4-[3-azanyl-1,1,1-tris(fluoranyl)propan-2-yl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[3-azanyl-1,1,1-tris(fluoranyl)propan-2-yl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[1-(aminomethyl)-2,2,2-trifluoro-ethyl]sulfanylphenyl]acetamide CAS Name: N-[4-[(3-amino-1,1,1-trifluoropropan-2-yl)thio]phenyl]acetamide IUPAC Name: N-[4-(3-amino-1,1,1-trifluoropropan-2-yl)sulfanylphenyl]acetamide Traditional Name: N-[4-[[1-(aminomethyl)-2,2,2-trifluoro-ethyl]thio]phenyl]acetamide Formula: C11H13F3N2OS MolecularWeight: 278.29393

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC(CN)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC(CN)C(F)(F)F

InChI

InChI=1S/C11H13F3N2OS/c1-7(17)16-8-2-4-9(5-3-8)18-10(6-15)11(12,13)14/h2-5,10H,6,15H2,1H3,(H,16,17)