N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethylpiperazin-1-yl)-2-sulfanylidene-ethanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethylpiperazin-1-yl)-2-sulfanylidene-ethanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethylpiperazin-1-yl)-2-thioxo-acetamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethyl-1-piperazinyl)-2-sulfanylideneacetamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethylpiperazin-1-yl)-2-sulfanylideneacetamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethylpiperazino)-2-thioxo-acetamide Formula: C16H17F6N3OS MolecularWeight: 413.381099

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=S)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCN1CCN(CC1)C(=S)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H17F6N3OS/c1-2-24-3-5-25(6-4-24)14(27)13(26)23-12-8-10(15(17,18)19)7-11(9-12)16(20,21)22/h7-9H,2-6H2,1H3,(H,23,26)