(E)-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(C)C(=O)NNC(=S)NC(=O)C=CC2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(C)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CS2)C

InChI

InChI=1S/C19H21N3O3S2/c1-12-6-7-15(11-13(12)2)25-14(3)18(24)21-22-19(26)20-17(23)9-8-16-5-4-10-27-16/h4-11,14H,1-3H3,(H,21,24)(H2,20,22,23,26)/b9-8+