(E)-3-(4-fluorophenyl)-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-fluorophenyl)-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-fluorophenyl)-N-[[2-(2-naphthyloxy)propanoylamino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-fluorophenyl)-N-[[[2-(2-naphthalenyloxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-fluorophenyl)-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-fluorophenyl)-N-[[2-(2-naphthoxy)propanoylamino]thiocarbamoyl]acrylamide Formula: C23H20FN3O3S MolecularWeight: 437.486603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC(=O)C=CC1=CC=C(C=C1)F)OC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NNC(=S)NC(=O)/C=C/C1=CC=C(C=C1)F)OC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H20FN3O3S/c1-15(30-20-12-9-17-4-2-3-5-18(17)14-20)22(29)26-27-23(31)25-21(28)13-8-16-6-10-19(24)11-7-16/h2-15H,1H3,(H,26,29)(H2,25,27,28,31)/b13-8+