N-(1,3-benzothiazol-2-yl)-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-(2-thienylsulfonyl)nipecotamide Formula: C18H19N3O3S3 MolecularWeight: 421.55676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H19N3O3S3/c1-20(18-19-14-7-2-3-8-15(14)26-18)17(22)13-6-4-10-21(12-13)27(23,24)16-9-5-11-25-16/h2-3,5,7-9,11,13H,4,6,10,12H2,1H3