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

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[(4-prop-2-enoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[[(4-allyloxybenzoyl)amino]carbamothioyl]-3-(4-ethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[[oxo-(4-prop-2-enoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[(4-prop-2-enoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(4-allyloxybenzoyl)amino]thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4S/c1-3-15-29-19-12-8-17(9-13-19)21(27)24-25-22(30)23-20(26)14-7-16-5-10-18(11-6-16)28-4-2/h3,5-14H,1,4,15H2,2H3,(H,24,27)(H2,23,25,26,30)/b14-7+