1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(4-nitroimidazol-1-yl)ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(4-nitroimidazol-1-yl)ethanone Openeye Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(4-nitroimidazol-1-yl)ethanone CAS Name: 1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-2-(4-nitro-1-imidazolyl)ethanone IUPAC Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(4-nitroimidazol-1-yl)ethanone Traditional Name: 1-[4-(4-fluorophenyl)sulfonylpiperazino]-2-(4-nitroimidazol-1-yl)ethanone Formula: C15H16FN5O5S MolecularWeight: 397.381443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=C(N=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=C(N=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C15H16FN5O5S/c16-12-1-3-13(4-2-12)27(25,26)20-7-5-19(6-8-20)15(22)10-18-9-14(17-11-18)21(23)24/h1-4,9,11H,5-8,10H2