1-(5-chloranylthiophen-2-yl)sulfonyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-[2-(1-pyrazolyl)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyrazol-1-ylethyl)nipecotamide Formula: C22H21ClFN5O3S3 MolecularWeight: 554.080243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)N(CCN3C=CC=N3)C4=NC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)N(CCN3C=CC=N3)C4=NC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C22H21ClFN5O3S3/c23-19-6-7-20(34-19)35(31,32)28-10-1-3-15(14-28)21(30)29(12-11-27-9-2-8-25-27)22-26-17-5-4-16(24)13-18(17)33-22/h2,4-9,13,15H,1,3,10-12,14H2