N-[2-(diethylamino)-2-phenyl-ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(diethylamino)-2-phenylethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(diethylamino)-2-phenylethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C22H31N3O3S2 MolecularWeight: 449.62984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C22H31N3O3S2/c1-3-24(4-2)20(18-9-6-5-7-10-18)17-23-22(26)19-12-14-25(15-13-19)30(27,28)21-11-8-16-29-21/h5-11,16,19-20H,3-4,12-15,17H2,1-2H3,(H,23,26)