N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-[(1-methylimidazol-2-yl)thio]ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C16H22N4O3S3 MolecularWeight: 414.56588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN1C=CN=C1SCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H22N4O3S3/c1-19-9-6-18-16(19)25-11-7-17-15(21)13-4-2-8-20(12-13)26(22,23)14-5-3-10-24-14/h3,5-6,9-10,13H,2,4,7-8,11-12H2,1H3,(H,17,21)