1-(1,2-dimethylimidazol-4-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(1,2-dimethylimidazol-4-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(1,2-dimethylimidazol-4-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine CAS Name: 1-[(1,2-dimethyl-4-imidazolyl)sulfonyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(1,2-dimethylimidazol-4-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(1,2-dimethylimidazol-4-yl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Formula: C16H18F3N5O4S MolecularWeight: 433.40543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H18F3N5O4S/c1-11-20-15(10-21(11)2)29(27,28)23-7-5-22(6-8-23)13-4-3-12(16(17,18)19)9-14(13)24(25)26/h3-4,9-10H,5-8H2,1-2H3