1-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]sulfonylpiperidine

Systemtic Name: 1-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]sulfonylpiperidine Openeye Name: 1-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]sulfonylpiperidine CAS Name: 1-[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]sulfonylpiperidine IUPAC Name: 1-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]sulfonylpiperidine Traditional Name: 1-[4-[(1-methylimidazol-2-yl)thio]-3-nitro-phenyl]sulfonylpiperidine Formula: C15H18N4O4S2 MolecularWeight: 382.45782

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4S2/c1-17-10-7-16-15(17)24-14-6-5-12(11-13(14)19(20)21)25(22,23)18-8-3-2-4-9-18/h5-7,10-11H,2-4,8-9H2,1H3