N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-N-(6-bromo-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-N-(6-bromo-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-benzyl-N-(6-bromo-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C26H23BrFN3O3S2 MolecularWeight: 588.511523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)Br)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)Br)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C26H23BrFN3O3S2/c27-20-10-11-22-23(16-20)35-26(29-22)31(17-18-6-2-1-3-7-18)25(32)19-12-14-30(15-13-19)36(33,34)24-9-5-4-8-21(24)28/h1-11,16,19H,12-15,17H2