5-(3,5-dinitrophenyl)-3-(piperidin-1-ylmethyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(3,5-dinitrophenyl)-3-(piperidin-1-ylmethyl)-1,3,4-oxadiazole-2-thione Openeye Name: 5-(3,5-dinitrophenyl)-3-(1-piperidylmethyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(3,5-dinitrophenyl)-3-(1-piperidinylmethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(3,5-dinitrophenyl)-3-(piperidin-1-ylmethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 5-(3,5-dinitrophenyl)-3-(piperidinomethyl)-1,3,4-oxadiazole-2-thione Formula: C14H15N5O5S MolecularWeight: 365.3644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C(=S)OC(=N2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CN2C(=S)OC(=N2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O5S/c20-18(21)11-6-10(7-12(8-11)19(22)23)13-15-17(14(25)24-13)9-16-4-2-1-3-5-16/h6-8H,1-5,9H2