1-(5-methylthiophen-2-yl)sulfonyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[2-(pyrazol-1-ylmethyl)benzyl]nipecotamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C22H26N4O3S2/c1-17-9-10-21(30-17)31(28,29)26-13-4-8-20(16-26)22(27)23-14-18-6-2-3-7-19(18)15-25-12-5-11-24-25/h2-3,5-7,9-12,20H,4,8,13-16H2,1H3,(H,23,27)