S-[(3Z)-3-[[1-(2-methoxyethyl)pyrazol-3-yl]methylidene]piperidin-4-yl] ethanethioate

Systemtic Name: S-[(3Z)-3-[[1-(2-methoxyethyl)pyrazol-3-yl]methylidene]piperidin-4-yl] ethanethioate Openeye Name: S-[(3Z)-3-[[1-(2-methoxyethyl)pyrazol-3-yl]methylene]-4-piperidyl] ethanethioate CAS Name: ethanethioic acid S-[(3Z)-3-[[1-(2-methoxyethyl)-3-pyrazolyl]methylidene]-4-piperidinyl] ester IUPAC Name: S-[(3Z)-3-[[1-(2-methoxyethyl)pyrazol-3-yl]methylidene]piperidin-4-yl] ethanethioate Traditional Name: ethanethioic acid S-[(3Z)-3-[[1-(2-methoxyethyl)pyrazol-3-yl]methylene]-4-piperidyl] ester Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CCNCC1=CC2=NN(C=C2)CCOC

Isomeric SMILES

CC(=O)SC\1CCNC/C1=C/C2=NN(C=C2)CCOC

InChI

InChI=1S/C14H21N3O2S/c1-11(18)20-14-3-5-15-10-12(14)9-13-4-6-17(16-13)7-8-19-2/h4,6,9,14-15H,3,5,7-8,10H2,1-2H3/b12-9-