(2-azanyl-5-fluoranyl-3-nitro-phenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-azanyl-5-fluoranyl-3-nitro-phenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-amino-5-fluoro-3-nitro-phenyl)-[4-(3-pyridylsulfonyl)piperazin-1-yl]methanone CAS Name: (2-amino-5-fluoro-3-nitrophenyl)-[4-(3-pyridinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-amino-5-fluoro-3-nitrophenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (2-amino-5-fluoro-3-nitro-phenyl)-[4-(3-pyridylsulfonyl)piperazino]methanone Formula: C16H16FN5O5S MolecularWeight: 409.392143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CC(=C2N)[N+](=O)[O-])F)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CC(=C2N)[N+](=O)[O-])F)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C16H16FN5O5S/c17-11-8-13(15(18)14(9-11)22(24)25)16(23)20-4-6-21(7-5-20)28(26,27)12-2-1-3-19-10-12/h1-3,8-10H,4-7,18H2