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

Systemtic Name: N-benzo[g][1,3]benzothiazol-2-yl-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-benzo[g][1,3]benzothiazol-2-yl-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-benzo[g][1,3]benzothiazolyl)-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-benzo[g][1,3]benzothiazol-2-yl-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-benzo[g][1,3]benzothiazol-2-yl-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C23H20FN3O3S2 MolecularWeight: 469.551603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=C(S2)C4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=C(S2)C4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H20FN3O3S2/c24-17-6-8-18(9-7-17)32(29,30)27-13-11-16(12-14-27)22(28)26-23-25-20-10-5-15-3-1-2-4-19(15)21(20)31-23/h1-10,16H,11-14H2,(H,25,26,28)