N-butyl-2-[4-[[4-(trifluoromethyloxy)phenyl]carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[[4-(trifluoromethyloxy)phenyl]carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[[4-(trifluoromethoxy)phenyl]carbamothioyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[sulfanylidene-[4-(trifluoromethoxy)anilino]methyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[[4-(trifluoromethoxy)phenyl]carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[[4-(trifluoromethoxy)phenyl]thiocarbamoyl]piperazino]acetamide Formula: C18H25F3N4O2S MolecularWeight: 418.47691

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C18H25F3N4O2S/c1-2-3-8-22-16(26)13-24-9-11-25(12-10-24)17(28)23-14-4-6-15(7-5-14)27-18(19,20)21/h4-7H,2-3,8-13H2,1H3,(H,22,26)(H,23,28)