(3S)-N-(3-morpholin-4-ylsulfonylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(3-morpholin-4-ylsulfonylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(3-morpholinosulfonylphenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[3-(4-morpholinylsulfonyl)phenyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(3-morpholin-4-ylsulfonylphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(3-morpholinosulfonylphenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C20H25N3O6S3 MolecularWeight: 499.624

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H25N3O6S3/c24-20(16-4-2-8-23(15-16)32(27,28)19-7-3-13-30-19)21-17-5-1-6-18(14-17)31(25,26)22-9-11-29-12-10-22/h1,3,5-7,13-14,16H,2,4,8-12,15H2,(H,21,24)/t16-/m0/s1