5-(4-methoxyphenyl)-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(4-methoxyphenyl)-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(4-methoxyphenyl)-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(4-methoxyphenyl)-3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(4-methoxyphenyl)-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(4-methoxyphenyl)-3-[[4-(4-nitrophenyl)piperazino]methyl]-1,3,4-oxadiazole-2-thione Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4S/c1-28-18-8-2-15(3-9-18)19-21-24(20(30)29-19)14-22-10-12-23(13-11-22)16-4-6-17(7-5-16)25(26)27/h2-9H,10-14H2,1H3