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

Systemtic Name: 5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Openeye Name: 5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole CAS Name: 5-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-3-propyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Traditional Name: 5-[(4-nosylpiperazino)methyl]-3-propyl-1,2,4-oxadiazole Formula: C16H21N5O5S MolecularWeight: 395.43344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O5S/c1-2-3-15-17-16(26-18-15)12-19-8-10-20(11-9-19)27(24,25)14-6-4-13(5-7-14)21(22)23/h4-7H,2-3,8-12H2,1H3