methyl 6-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]hexanoate CAS Name: 6-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]hexanoate Traditional Name: 6-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]hexanoic acid methyl ester Formula: C17H26N2O5S2 MolecularWeight: 402.52874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H26N2O5S2/c1-24-15(20)6-3-2-4-10-18-17(21)14-8-11-19(12-9-14)26(22,23)16-7-5-13-25-16/h5,7,13-14H,2-4,6,8-12H2,1H3,(H,18,21)