ethyl 3-[(5-fluoranyl-2-methyl-phenyl)methylcarbamothioylamino]benzoate

Systemtic Name: ethyl 3-[(5-fluoranyl-2-methyl-phenyl)methylcarbamothioylamino]benzoate Openeye Name: ethyl 3-[(5-fluoro-2-methyl-phenyl)methylcarbamothioylamino]benzoate CAS Name: 3-[[[(5-fluoro-2-methylphenyl)methylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(5-fluoro-2-methylphenyl)methylcarbamothioylamino]benzoate Traditional Name: 3-[(5-fluoro-2-methyl-benzyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C18H19FN2O2S MolecularWeight: 346.419063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCC2=C(C=CC(=C2)F)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCC2=C(C=CC(=C2)F)C

InChI

InChI=1S/C18H19FN2O2S/c1-3-23-17(22)13-5-4-6-16(10-13)21-18(24)20-11-14-9-15(19)8-7-12(14)2/h4-10H,3,11H2,1-2H3,(H2,20,21,24)