N-[3-(1,3-dithian-2-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[3-(1,3-dithian-2-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[3-(1,3-dithian-2-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[3-(1,3-dithian-2-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[3-(1,3-dithian-2-yl)phenyl]isonipecotamide Formula: C22H26N2O3S3 MolecularWeight: 462.64844

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3S3/c25-21(23-19-7-4-6-18(16-19)22-28-14-5-15-29-22)17-10-12-24(13-11-17)30(26,27)20-8-2-1-3-9-20/h1-4,6-9,16-17,22H,5,10-15H2,(H,23,25)