(E)-3-(4-ethoxyphenyl)-N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[(2-fluoro-5-nitrophenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C18H16FN3O4S MolecularWeight: 389.400743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C18H16FN3O4S/c1-2-26-14-7-3-12(4-8-14)5-10-17(23)21-18(27)20-16-11-13(22(24)25)6-9-15(16)19/h3-11H,2H2,1H3,(H2,20,21,23,27)/b10-5+