N-butyl-2-[4-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[(3-fluoro-4-methyl-phenyl)carbamothioyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[(3-fluoro-4-methylphenyl)carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[(3-fluoro-4-methyl-phenyl)thiocarbamoyl]piperazino]acetamide Formula: C18H27FN4OS MolecularWeight: 366.496583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27FN4OS/c1-3-4-7-20-17(24)13-22-8-10-23(11-9-22)18(25)21-15-6-5-14(2)16(19)12-15/h5-6,12H,3-4,7-11,13H2,1-2H3,(H,20,24)(H,21,25)