ethyl 4-[2-oxidanylidene-2-[2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]hydrazinyl]ethoxy]benzoate

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]hydrazinyl]ethoxy]benzoate Openeye Name: ethyl 4-[2-oxo-2-[2-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioyl]hydrazino]ethoxy]benzoate CAS Name: 4-[2-oxo-2-[[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]hydrazo]ethoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-[2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]hydrazinyl]ethoxy]benzoate Traditional Name: 4-[2-keto-2-[N'-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoyl]hydrazino]ethoxy]benzoic acid ethyl ester Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C19H19N3O5S2/c1-2-26-18(25)13-5-7-14(8-6-13)27-12-17(24)21-22-19(28)20-16(23)10-9-15-4-3-11-29-15/h3-11H,2,12H2,1H3,(H,21,24)(H2,20,22,23,28)/b10-9+