1-(3,4-dimethoxyphenyl)sulfonyl-4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazine

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazine Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazine CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[3-(3,5-dimethyl-1-pyrazolyl)-4-nitrophenyl]piperazine IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]piperazine Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazine Formula: C23H27N5O6S MolecularWeight: 501.55538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)OC)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)OC)OC)[N+](=O)[O-])C

InChI

InChI=1S/C23H27N5O6S/c1-16-13-17(2)27(24-16)21-14-18(5-7-20(21)28(29)30)25-9-11-26(12-10-25)35(31,32)19-6-8-22(33-3)23(15-19)34-4/h5-8,13-15H,9-12H2,1-4H3