ethyl 1-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methyl]isonipecotic acid ethyl ester Formula: C19H32N4O4S MolecularWeight: 412.54678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CN2C(=C(C(=N2)C)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CN2C(=C(C(=N2)C)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C19H32N4O4S/c1-4-27-19(24)17-8-12-21(13-9-17)14-23-16(3)18(15(2)20-23)28(25,26)22-10-6-5-7-11-22/h17H,4-14H2,1-3H3