N-[2-(phenylmethyl)pyrazol-3-yl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(phenylmethyl)pyrazol-3-yl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(phenylmethyl)-3-pyrazolyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H22N4O3S2/c25-20(22-18-8-11-21-24(18)15-16-5-2-1-3-6-16)17-9-12-23(13-10-17)29(26,27)19-7-4-14-28-19/h1-8,11,14,17H,9-10,12-13,15H2,(H,22,25)