3-(2-ethoxyphenyl)-5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(2-ethoxyphenyl)-5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(2-ethoxyphenyl)-5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-ethoxyphenyl)-5-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-ethoxyphenyl)-5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-[(4-nosylpiperazino)methyl]-3-o-phenetyl-1,2,4-oxadiazole Formula: C21H23N5O6S MolecularWeight: 473.50222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O6S/c1-2-31-19-6-4-3-5-18(19)21-22-20(32-23-21)15-24-11-13-25(14-12-24)33(29,30)17-9-7-16(8-10-17)26(27)28/h3-10H,2,11-15H2,1H3