2-fluoranyl-N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-fluoro-N-[(1S)-2-methyl-1-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]propyl]benzamide CAS Name: 2-fluoro-N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-fluoro-N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-1-oxobutan-2-yl]benzamide Traditional Name: 2-fluoro-N-[(1S)-2-methyl-1-(4-nosylpiperazine-1-carbonyl)propyl]benzamide Formula: C22H25FN4O6S MolecularWeight: 492.520503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H25FN4O6S/c1-15(2)20(24-21(28)18-5-3-4-6-19(18)23)22(29)25-11-13-26(14-12-25)34(32,33)17-9-7-16(8-10-17)27(30)31/h3-10,15,20H,11-14H2,1-2H3,(H,24,28)/t20-/m0/s1