2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(4-nitropyrazol-1-yl)propan-1-one

Systemtic Name: 2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(4-nitropyrazol-1-yl)propan-1-one Openeye Name: 2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(4-nitropyrazol-1-yl)propan-1-one CAS Name: 2-methyl-1-[4-[(1-methyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]-3-(4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(4-nitropyrazol-1-yl)propan-1-one Traditional Name: 2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazino]-3-(4-nitropyrazol-1-yl)propan-1-one Formula: C15H21N7O5S MolecularWeight: 411.43614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N7O5S/c1-12(9-20-10-13(7-17-20)22(24)25)15(23)19-3-5-21(6-4-19)28(26,27)14-8-16-18(2)11-14/h7-8,10-12H,3-6,9H2,1-2H3