(2-methyl-4-nitro-pyrazol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-methyl-4-nitro-pyrazol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-methyl-4-nitro-pyrazol-3-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (2-methyl-4-nitro-3-pyrazolyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (2-methyl-4-nitropyrazol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (2-methyl-4-nitro-pyrazol-3-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C13H15N5O5S2 MolecularWeight: 385.4187

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C13H15N5O5S2/c1-15-12(10(9-14-15)18(20)21)13(19)16-4-6-17(7-5-16)25(22,23)11-3-2-8-24-11/h2-3,8-9H,4-7H2,1H3