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

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-pyridylmethyl)isonipecotamide Formula: C27H27FN4O3S2 MolecularWeight: 538.656683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C27H27FN4O3S2/c1-2-19-8-7-11-23-25(19)30-27(36-23)32(18-21-9-5-6-15-29-21)26(33)20-13-16-31(17-14-20)37(34,35)24-12-4-3-10-22(24)28/h3-12,15,20H,2,13-14,16-18H2,1H3