(3R)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(4-pyrrolidinosulfonylphenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C20H25N3O5S3 MolecularWeight: 483.6246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CCCN(C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H25N3O5S3/c24-20(16-5-3-13-23(15-16)31(27,28)19-6-4-14-29-19)21-17-7-9-18(10-8-17)30(25,26)22-11-1-2-12-22/h4,6-10,14,16H,1-3,5,11-13,15H2,(H,21,24)/t16-/m1/s1