methyl 2-[(3-fluorophenyl)carbonylcarbamothioyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[(3-fluorophenyl)carbonylcarbamothioyl-methyl-amino]ethanoate Openeye Name: methyl 2-[(3-fluorobenzoyl)carbamothioyl-methyl-amino]acetate CAS Name: 2-[[[[(3-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(3-fluorobenzoyl)carbamothioyl-methylamino]acetate Traditional Name: 2-[(3-fluorobenzoyl)thiocarbamoyl-methyl-amino]acetic acid methyl ester Formula: C12H13FN2O3S MolecularWeight: 284.306623

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=S)NC(=O)C1=CC(=CC=C1)F

Isomeric SMILES

CN(CC(=O)OC)C(=S)NC(=O)C1=CC(=CC=C1)F

InChI

InChI=1S/C12H13FN2O3S/c1-15(7-10(16)18-2)12(19)14-11(17)8-4-3-5-9(13)6-8/h3-6H,7H2,1-2H3,(H,14,17,19)