(E)-3-(4-ethoxyphenyl)-N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[[3-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[3-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-p-phenetyl-N-[[3-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]acrylamide Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC(=CC=C2)OCC3CCCO3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC(=CC=C2)OCC3CCCO3

InChI

InChI=1S/C23H26N2O4S/c1-2-27-19-11-8-17(9-12-19)10-13-22(26)25-23(30)24-18-5-3-6-20(15-18)29-16-21-7-4-14-28-21/h3,5-6,8-13,15,21H,2,4,7,14,16H2,1H3,(H2,24,25,26,30)/b13-10+