ethyl 1-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[[(E)-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[[(E)-3-(2-methoxyphenyl)acryloyl]thiocarbamoyl]isonipecotic acid ethyl ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)C=CC2=CC=CC=C2OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC(=O)/C=C/C2=CC=CC=C2OC

InChI

InChI=1S/C19H24N2O4S/c1-3-25-18(23)15-10-12-21(13-11-15)19(26)20-17(22)9-8-14-6-4-5-7-16(14)24-2/h4-9,15H,3,10-13H2,1-2H3,(H,20,22,26)/b9-8+