4-chloranyl-3,5-bis(1-methylpyrazol-4-yl)-1-(3-nitrophenyl)sulfonyl-pyrazole

Systemtic Name: 4-chloranyl-3,5-bis(1-methylpyrazol-4-yl)-1-(3-nitrophenyl)sulfonyl-pyrazole Openeye Name: 4-chloro-3,5-bis(1-methylpyrazol-4-yl)-1-(3-nitrophenyl)sulfonyl-pyrazole CAS Name: 4-chloro-3,5-bis(1-methyl-4-pyrazolyl)-1-(3-nitrophenyl)sulfonylpyrazole IUPAC Name: 4-chloro-3,5-bis(1-methylpyrazol-4-yl)-1-(3-nitrophenyl)sulfonylpyrazole Traditional Name: 4-chloro-3,5-bis(1-methylpyrazol-4-yl)-1-(3-nitrophenyl)sulfonyl-pyrazole Formula: C17H14ClN7O4S MolecularWeight: 447.85556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=C(C(=NN2S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CN(N=C4)C)Cl

Isomeric SMILES

CN1C=C(C=N1)C2=C(C(=NN2S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CN(N=C4)C)Cl

InChI

InChI=1S/C17H14ClN7O4S/c1-22-9-11(7-19-22)16-15(18)17(12-8-20-23(2)10-12)24(21-16)30(28,29)14-5-3-4-13(6-14)25(26)27/h3-10H,1-2H3