ethyl 4-[(5-fluoranyl-2-methyl-phenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(5-fluoranyl-2-methyl-phenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(5-fluoro-2-methyl-phenyl)carbamothioylamino]benzoate CAS Name: 4-[[(5-fluoro-2-methylanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-fluoro-2-methylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(5-fluoro-2-methyl-phenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H17FN2O2S MolecularWeight: 332.392483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)F)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)F)C

InChI

InChI=1S/C17H17FN2O2S/c1-3-22-16(21)12-5-8-14(9-6-12)19-17(23)20-15-10-13(18)7-4-11(15)2/h4-10H,3H2,1-2H3,(H2,19,20,23)