N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide Openeye Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(tetrahydrofuran-2-ylmethyl)piperidine-4-carboxamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(2-oxolanylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide Traditional Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(tetrahydrofurfuryl)isonipecotamide Formula: C26H30FN3O4S2 MolecularWeight: 531.662503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3CCCO3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3CCCO3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F)C

InChI

InChI=1S/C26H30FN3O4S2/c1-17-9-10-22-24(18(17)2)28-26(35-22)30(16-20-6-5-15-34-20)25(31)19-11-13-29(14-12-19)36(32,33)23-8-4-3-7-21(23)27/h3-4,7-10,19-20H,5-6,11-16H2,1-2H3