4-ethyl-N-[[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzamide

Systemtic Name: 4-ethyl-N-[[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzamide Openeye Name: 4-ethyl-N-[[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzamide CAS Name: 4-ethyl-N-[[[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethyl-N-[[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzamide Traditional Name: 4-ethyl-N-[[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]benzamide Formula: C23H18FN3O2S MolecularWeight: 419.471323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H18FN3O2S/c1-2-14-6-8-15(9-7-14)21(28)27-23(30)25-18-10-11-20-19(13-18)26-22(29-20)16-4-3-5-17(24)12-16/h3-13H,2H2,1H3,(H2,25,27,28,30)