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ethyl 1-(pyridin-3-ylmethylcarbamothioyl)piperidine-3-carboxylate

ethyl 1-(pyridin-3-ylmethylcarbamothioyl)piperidine-3-carboxylate

Systemtic Name:ethyl 1-(pyridin-3-ylmethylcarbamothioyl)piperidine-3-carboxylate
Openeye Name:ethyl 1-(3-pyridylmethylcarbamothioyl)piperidine-3-carboxylate
CAS Name:1-[(3-pyridinylmethylamino)-sulfanylidenemethyl]-3-piperidinecarboxylic acid ethyl ester
IUPAC Name:ethyl 1-(pyridin-3-ylmethylcarbamothioyl)piperidine-3-carboxylate
Traditional Name:1-(3-pyridylmethylthiocarbamoyl)nipecotic acid ethyl ester
Formula: C15H21N3O2S
MolecularWeight: 307.41114
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=S)NCC2=CN=CC=C2


Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=S)NCC2=CN=CC=C2


InChI

InChI=1S/C15H21N3O2S/c1-2-20-14(19)13-6-4-8-18(11-13)15(21)17-10-12-5-3-7-16-9-12/h3,5,7,9,13H,2,4,6,8,10-11H2,1H3,(H,17,21)


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