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

Systemtic Name: 1-(2-fluorophenyl)sulfonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(2-fluorophenyl)sulfonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(2-fluorophenyl)sulfonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-fluorophenyl)sulfonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)sulfonyl-N-(4-methoxy-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)isonipecotamide Formula: C26H25FN4O4S2 MolecularWeight: 540.629503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C26H25FN4O4S2/c1-35-21-8-4-9-22-24(21)29-26(36-22)31(17-18-6-5-13-28-16-18)25(32)19-11-14-30(15-12-19)37(33,34)23-10-3-2-7-20(23)27/h2-10,13,16,19H,11-12,14-15,17H2,1H3