N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(6-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=C(C=C4)Cl)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(C(C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)Cl)S(=O)(=O)C5=CC=CS5

InChI

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