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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C21H22FN3O3S2 MolecularWeight: 447.546083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C21H22FN3O3S2/c22-16-5-1-4-8-19(16)30(27,28)25-13-10-15(11-14-25)21(26)23-12-9-20-24-17-6-2-3-7-18(17)29-20/h1-8,15H,9-14H2,(H,23,26)