N-butyl-2-[[(2-fluorophenyl)methyl-(phenylmethyl)carbamothioyl]amino]ethanamide

Systemtic Name: N-butyl-2-[[(2-fluorophenyl)methyl-(phenylmethyl)carbamothioyl]amino]ethanamide Openeye Name: 2-[[benzyl-[(2-fluorophenyl)methyl]carbamothioyl]amino]-N-butyl-acetamide CAS Name: N-butyl-2-[[[(2-fluorophenyl)methyl-(phenylmethyl)amino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: 2-[[benzyl-[(2-fluorophenyl)methyl]carbamothioyl]amino]-N-butylacetamide Traditional Name: 2-[[benzyl-(2-fluorobenzyl)thiocarbamoyl]amino]-N-butyl-acetamide Formula: C21H26FN3OS MolecularWeight: 387.514043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CNC(=S)N(CC1=CC=CC=C1)CC2=CC=CC=C2F

Isomeric SMILES

CCCCNC(=O)CNC(=S)N(CC1=CC=CC=C1)CC2=CC=CC=C2F

InChI

InChI=1S/C21H26FN3OS/c1-2-3-13-23-20(26)14-24-21(27)25(15-17-9-5-4-6-10-17)16-18-11-7-8-12-19(18)22/h4-12H,2-3,13-16H2,1H3,(H,23,26)(H,24,27)