N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: 1-esyl-N-[2-(4-ethylbenzyl)pyrazol-3-yl]isonipecotamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C20H28N4O3S/c1-3-16-5-7-17(8-6-16)15-24-19(9-12-21-24)22-20(25)18-10-13-23(14-11-18)28(26,27)4-2/h5-9,12,18H,3-4,10-11,13-15H2,1-2H3,(H,22,25)