1-(2-fluorophenyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]piperidine-4-carboxamide Openeye Name: 1-(2-fluorophenyl)-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]piperidine-4-carboxamide CAS Name: 1-(2-fluorophenyl)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-fluorophenyl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]piperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-(5-nosylthiazol-2-yl)isonipecotamide Formula: C21H19FN4O5S2 MolecularWeight: 490.527763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4F

InChI

InChI=1S/C21H19FN4O5S2/c22-17-3-1-2-4-18(17)25-11-9-14(10-12-25)20(27)24-21-23-13-19(32-21)33(30,31)16-7-5-15(6-8-16)26(28)29/h1-8,13-14H,9-12H2,(H,23,24,27)