1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyrazol-1-yl-propan-1-one

Systemtic Name: 1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyrazol-1-yl-propan-1-one Openeye Name: 1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyrazol-1-yl-propan-1-one CAS Name: 1-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-2-(1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyrazol-1-ylpropan-1-one Traditional Name: 1-[4-(2-nitrophenyl)sulfonylpiperazino]-2-pyrazol-1-yl-propan-1-one Formula: C16H19N5O5S MolecularWeight: 393.41756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N3C=CC=N3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N3C=CC=N3

InChI

InChI=1S/C16H19N5O5S/c1-13(20-8-4-7-17-20)16(22)18-9-11-19(12-10-18)27(25,26)15-6-3-2-5-14(15)21(23)24/h2-8,13H,9-12H2,1H3