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

Systemtic Name: (E)-3-(4-fluorophenyl)-N-[[(4-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[(4-allyloxybenzoyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-3-(4-fluorophenyl)-N-[[[oxo-(4-prop-2-enoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-fluorophenyl)-N-[[(4-prop-2-enoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(4-allyloxybenzoyl)amino]thiocarbamoyl]-3-(4-fluorophenyl)acrylamide Formula: C20H18FN3O3S MolecularWeight: 399.438623

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C=CC2=CC=C(C=C2)F

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=C(C=C2)F

InChI

InChI=1S/C20H18FN3O3S/c1-2-13-27-17-10-6-15(7-11-17)19(26)23-24-20(28)22-18(25)12-5-14-3-8-16(21)9-4-14/h2-12H,1,13H2,(H,23,26)(H2,22,24,25,28)/b12-5+