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

Systemtic Name: (2-ethyl-4-nitro-pyrazol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-ethyl-4-nitro-pyrazol-3-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (2-ethyl-4-nitro-3-pyrazolyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (2-ethyl-4-nitropyrazol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (2-ethyl-4-nitro-pyrazol-3-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C14H17N5O5S2 MolecularWeight: 399.44528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C14H17N5O5S2/c1-2-18-13(11(10-15-18)19(21)22)14(20)16-5-7-17(8-6-16)26(23,24)12-4-3-9-25-12/h3-4,9-10H,2,5-8H2,1H3