1-(2-fluorophenyl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-fluorophenyl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(2-fluorophenyl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(2-fluorophenyl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-fluorophenyl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)isonipecotamide Formula: C26H25FN4O3S2 MolecularWeight: 524.630103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CC3=CN=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CC3=CN=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C26H25FN4O3S2/c1-18-8-9-22-23(15-18)35-26(29-22)31(17-19-5-4-12-28-16-19)25(32)20-10-13-30(14-11-20)36(33,34)24-7-3-2-6-21(24)27/h2-9,12,15-16,20H,10-11,13-14,17H2,1H3