N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H26ClN3O3S2/c22-17-6-7-19(24-10-2-1-3-11-24)18(15-17)23-21(26)16-8-12-25(13-9-16)30(27,28)20-5-4-14-29-20/h4-7,14-16H,1-3,8-13H2,(H,23,26)