N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-2-fluorobenzamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidino]sulfonylphenyl]-2-fluoro-benzamide Formula: C25H22FN3O3S2 MolecularWeight: 495.588883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C25H22FN3O3S2/c26-21-6-2-1-5-20(21)24(30)27-18-9-11-19(12-10-18)34(31,32)29-15-13-17(14-16-29)25-28-22-7-3-4-8-23(22)33-25/h1-12,17H,13-16H2,(H,27,30)