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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-2-thiophenyl]-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-1-(2-thienylsulfonyl)pipecolinamide Formula: C21H19N3O3S4 MolecularWeight: 489.65386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=C(C=CS2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=C(C=CS2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C21H19N3O3S4/c25-19(16-7-3-4-11-24(16)31(26,27)18-9-5-12-28-18)23-20-14(10-13-29-20)21-22-15-6-1-2-8-17(15)30-21/h1-2,5-6,8-10,12-13,16H,3-4,7,11H2,(H,23,25)