N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-fluoro-benzamide CAS Name: N-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-fluorobenzamide Traditional Name: N-[(6-ethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-fluoro-benzamide Formula: C17H14FN3O2S2 MolecularWeight: 375.440363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C17H14FN3O2S2/c1-2-23-10-7-8-13-14(9-10)25-17(19-13)21-16(24)20-15(22)11-5-3-4-6-12(11)18/h3-9H,2H2,1H3,(H2,19,20,21,22,24)