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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)sulfonyl-N-methyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)sulfonyl-N-methylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)sulfonyl-N-methyl-nipecotamide Formula: C20H20FN3O3S2 MolecularWeight: 433.519503

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H20FN3O3S2/c1-23(20-22-17-6-2-3-7-18(17)28-20)19(25)14-5-4-12-24(13-14)29(26,27)16-10-8-15(21)9-11-16/h2-3,6-11,14H,4-5,12-13H2,1H3