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

Systemtic Name: 2-[[(2-fluorophenyl)methyl-(phenylmethyl)carbamothioyl]amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[[benzyl-[(2-fluorophenyl)methyl]carbamothioyl]amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[[(2-fluorophenyl)methyl-(phenylmethyl)amino]-sulfanylidenemethyl]amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[[benzyl-[(2-fluorophenyl)methyl]carbamothioyl]amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[benzyl-(2-fluorobenzyl)thiocarbamoyl]amino]-N-(2-thenyl)acetamide Formula: C22H22FN3OS2 MolecularWeight: 427.557983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2F)C(=S)NCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2F)C(=S)NCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C22H22FN3OS2/c23-20-11-5-4-9-18(20)16-26(15-17-7-2-1-3-8-17)22(28)25-14-21(27)24-13-19-10-6-12-29-19/h1-12H,13-16H2,(H,24,27)(H,25,28)