(3R)-N-[(1-ethylpyrazol-4-yl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[(1-ethylpyrazol-4-yl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[(1-ethylpyrazol-4-yl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-[(1-ethyl-4-pyrazolyl)methyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[(1-ethylpyrazol-4-yl)methyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-[(1-ethylpyrazol-4-yl)methyl]-1-mesyl-nipecotamide Formula: C13H22N4O3S MolecularWeight: 314.40378

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CCN1C=C(C=N1)CNC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C13H22N4O3S/c1-3-16-9-11(8-15-16)7-14-13(18)12-5-4-6-17(10-12)21(2,19)20/h8-9,12H,3-7,10H2,1-2H3,(H,14,18)/t12-/m1/s1