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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H19FN4O3S3 MolecularWeight: 502.604663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H19FN4O3S3/c23-15-5-7-16(8-6-15)33(29,30)27-11-9-14(10-12-27)20(28)26-22-25-18(13-31-22)21-24-17-3-1-2-4-19(17)32-21/h1-8,13-14H,9-12H2,(H,25,26,28)