ethyl 1-[(1-methylpyrazol-3-yl)carbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1-methylpyrazol-3-yl)carbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-methylpyrazol-3-yl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[(1-methyl-3-pyrazolyl)amino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-methylpyrazol-3-yl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[(1-methylpyrazol-3-yl)thiocarbamoyl]isonipecotic acid ethyl ester Formula: C13H20N4O2S MolecularWeight: 296.3885

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NC2=NN(C=C2)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NC2=NN(C=C2)C

InChI

InChI=1S/C13H20N4O2S/c1-3-19-12(18)10-4-8-17(9-5-10)13(20)14-11-6-7-16(2)15-11/h6-7,10H,3-5,8-9H2,1-2H3,(H,14,15,20)