1-(4-nitrophenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine

Systemtic Name: 1-(4-nitrophenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine Openeye Name: 1-(4-nitrophenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine CAS Name: 1-(4-nitrophenyl)sulfonyl-4-[(1-phenyl-4-pyrazolyl)methyl]piperazine IUPAC Name: 1-(4-nitrophenyl)sulfonyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine Traditional Name: 1-nosyl-4-[(1-phenylpyrazol-4-yl)methyl]piperazine Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4S/c26-25(27)19-6-8-20(9-7-19)30(28,29)23-12-10-22(11-13-23)15-17-14-21-24(16-17)18-4-2-1-3-5-18/h1-9,14,16H,10-13,15H2