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

Systemtic Name: N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(1S)-2-(dimethylamino)-1-phenylethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(1S)-2-(dimethylamino)-1-phenylethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C)C[C@H](C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-22(2)15-18(16-7-4-3-5-8-16)21-20(24)17-10-12-23(13-11-17)28(25,26)19-9-6-14-27-19/h3-9,14,17-18H,10-13,15H2,1-2H3,(H,21,24)/t18-/m1/s1