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

Systemtic Name: 4-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[(1-methylimidazol-2-yl)thio]-3-nitro-phenyl]sulfonylmorpholine Formula: C14H16N4O5S2 MolecularWeight: 384.43064

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O5S2/c1-16-5-4-15-14(16)24-13-3-2-11(10-12(13)18(19)20)25(21,22)17-6-8-23-9-7-17/h2-5,10H,6-9H2,1H3