ethyl 1-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoyl]isonipecotic acid ethyl ester Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C16H20N2O3S2/c1-2-21-15(20)12-7-9-18(10-8-12)16(22)17-14(19)6-5-13-4-3-11-23-13/h3-6,11-12H,2,7-10H2,1H3,(H,17,19,22)/b6-5+