ethyl 5-[[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]methylidene]-2,4-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]methylidene]-2,4-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-[[2-[(4-fluorophenyl)carbamothioyl]hydrazino]methylene]-2,4-dimethyl-pyrrole-3-carboxylate CAS Name: 5-[[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazo]methylidene]-2,4-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]methylidene]-2,4-dimethylpyrrole-3-carboxylate Traditional Name: 5-[[N'-[(4-fluorophenyl)thiocarbamoyl]hydrazino]methylene]-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C17H19FN4O2S MolecularWeight: 362.421763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CNNC(=S)NC2=CC=C(C=C2)F)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CNNC(=S)NC2=CC=C(C=C2)F)N=C1C)C

InChI

InChI=1S/C17H19FN4O2S/c1-4-24-16(23)15-10(2)14(20-11(15)3)9-19-22-17(25)21-13-7-5-12(18)6-8-13/h5-9,19H,4H2,1-3H3,(H2,21,22,25)