N-(1,3-benzothiazol-5-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-5-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-5-yl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-5-yl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-5-yl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-5-yl)-1-(2-thienylsulfonyl)nipecotamide Formula: C17H17N3O3S3 MolecularWeight: 407.53018

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3)SC=N4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3)SC=N4

InChI

InChI=1S/C17H17N3O3S3/c21-17(19-13-5-6-15-14(9-13)18-11-25-15)12-3-1-7-20(10-12)26(22,23)16-4-2-8-24-16/h2,4-6,8-9,11-12H,1,3,7,10H2,(H,19,21)