N-[(2-imidazol-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2-imidazol-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(2-imidazol-1-ylphenyl)methyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[[2-(1-imidazolyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(2-imidazol-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(2-imidazol-1-ylbenzyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCC3=CC=CC=C3N4C=CN=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCC3=CC=CC=C3N4C=CN=C4

InChI

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