(E)-3-(4-fluorophenyl)-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-fluorophenyl)-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-fluorophenyl)-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-fluorophenyl)-N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-fluorophenyl)-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-fluorophenyl)-N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]acrylamide Formula: C21H16FN3O3S MolecularWeight: 409.433443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C(=CC2=C1)C(=O)NNC(=S)NC(=O)C=CC3=CC=C(C=C3)F)O

Isomeric SMILES

C1=CC=C2C=C(C(=CC2=C1)C(=O)NNC(=S)NC(=O)/C=C/C3=CC=C(C=C3)F)O

InChI

InChI=1S/C21H16FN3O3S/c22-16-8-5-13(6-9-16)7-10-19(27)23-21(29)25-24-20(28)17-11-14-3-1-2-4-15(14)12-18(17)26/h1-12,26H,(H,24,28)(H2,23,25,27,29)/b10-7+