N-(4-chloranyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-pyridylmethyl)isonipecotamide Formula: C25H22ClFN4O3S2 MolecularWeight: 545.048583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCC1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=CC=C4Cl)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C25H22ClFN4O3S2/c26-19-7-5-9-21-23(19)29-25(35-21)31(16-18-6-3-4-13-28-18)24(32)17-11-14-30(15-12-17)36(33,34)22-10-2-1-8-20(22)27/h1-10,13,17H,11-12,14-16H2