3,5-dimethyl-4-[[2-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]imidazol-1-yl]methyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[2-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]imidazol-1-yl]methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[2-[1-(2-methyl-5-nitro-phenyl)sulfonyl-4-piperidyl]imidazol-1-yl]methyl]isoxazole CAS Name: 3,5-dimethyl-4-[[2-[1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinyl]-1-imidazolyl]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[2-[1-(2-methyl-5-nitrophenyl)sulfonylpiperidin-4-yl]imidazol-1-yl]methyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[2-[1-(2-methyl-5-nitro-phenyl)sulfonyl-4-piperidyl]imidazol-1-yl]methyl]isoxazole Formula: C21H25N5O5S MolecularWeight: 459.5187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C3=NC=CN3CC4=C(ON=C4C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C3=NC=CN3CC4=C(ON=C4C)C

InChI

InChI=1S/C21H25N5O5S/c1-14-4-5-18(26(27)28)12-20(14)32(29,30)25-9-6-17(7-10-25)21-22-8-11-24(21)13-19-15(2)23-31-16(19)3/h4-5,8,11-12,17H,6-7,9-10,13H2,1-3H3