5-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Openeye Name: 5-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole CAS Name: 5-[[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-3-propyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Traditional Name: 5-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methyl]-3-propyl-1,2,4-oxadiazole Formula: C17H23N5O6S MolecularWeight: 425.45942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O6S/c1-3-4-16-18-17(28-19-16)12-20-7-9-21(10-8-20)29(25,26)13-5-6-15(27-2)14(11-13)22(23)24/h5-6,11H,3-4,7-10,12H2,1-2H3