N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C22H20ClN3O4S3 MolecularWeight: 522.0599

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4Cl)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(C(C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4Cl)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H20ClN3O4S3/c23-16-7-3-9-18-20(16)24-22(32-18)25(14-15-6-4-12-30-15)21(27)17-8-1-2-11-26(17)33(28,29)19-10-5-13-31-19/h3-7,9-10,12-13,17H,1-2,8,11,14H2