2-[[cyclohexyl-[(4-fluorophenyl)methyl]carbamothioyl]amino]ethanoic acid

Systemtic Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]carbamothioyl]amino]ethanoic acid Openeye Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]carbamothioyl]amino]acetic acid CAS Name: 2-[[[cyclohexyl-[(4-fluorophenyl)methyl]amino]-sulfanylidenemethyl]amino]acetic acid IUPAC Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]carbamothioyl]amino]acetic acid Traditional Name: 2-[[cyclohexyl-(4-fluorobenzyl)thiocarbamoyl]amino]acetic acid Formula: C16H21FN2O2S MolecularWeight: 324.413543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=C(C=C2)F)C(=S)NCC(=O)O

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=C(C=C2)F)C(=S)NCC(=O)O

InChI

InChI=1S/C16H21FN2O2S/c17-13-8-6-12(7-9-13)11-19(14-4-2-1-3-5-14)16(22)18-10-15(20)21/h6-9,14H,1-5,10-11H2,(H,18,22)(H,20,21)