diethyl 2-[(3-fluorophenyl)carbamothioylamino]benzene-1,4-dicarboxylate

Systemtic Name: diethyl 2-[(3-fluorophenyl)carbamothioylamino]benzene-1,4-dicarboxylate Openeye Name: diethyl 2-[(3-fluorophenyl)carbamothioylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[(3-fluoroanilino)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[(3-fluorophenyl)carbamothioylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[(3-fluorophenyl)thiocarbamoylamino]benzene-1,4-dicarboxylic acid diethyl ester Formula: C19H19FN2O4S MolecularWeight: 390.428563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19FN2O4S/c1-3-25-17(23)12-8-9-15(18(24)26-4-2)16(10-12)22-19(27)21-14-7-5-6-13(20)11-14/h5-11H,3-4H2,1-2H3,(H2,21,22,27)