1-[5-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonylthiophen-2-yl]ethanone

Systemtic Name: 1-[5-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonylthiophen-2-yl]ethanone Openeye Name: 1-[5-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-thienyl]ethanone CAS Name: 1-[5-[[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]thiophen-2-yl]ethanone Traditional Name: 1-[5-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-thienyl]ethanone Formula: C17H17N3O6S2 MolecularWeight: 423.46338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6S2/c1-12(21)15-5-6-16(27-15)17(22)18-7-9-19(10-8-18)28(25,26)14-4-2-3-13(11-14)20(23)24/h2-6,11H,7-10H2,1H3