2,5-bis(2,4,6-trinitrophenyl)-1,3,4-thiadiazole

Systemtic Name: 2,5-bis(2,4,6-trinitrophenyl)-1,3,4-thiadiazole Openeye Name: 2,5-bis(2,4,6-trinitrophenyl)-1,3,4-thiadiazole CAS Name: 2,5-bis(2,4,6-trinitrophenyl)-1,3,4-thiadiazole IUPAC Name: 2,5-bis(2,4,6-trinitrophenyl)-1,3,4-thiadiazole Traditional Name: 2,5-dipicryl-1,3,4-thiadiazole Formula: C14H4N8O12S MolecularWeight: 508.29296

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])C2=NN=C(S2)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])C2=NN=C(S2)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H4N8O12S/c23-17(24)5-1-7(19(27)28)11(8(2-5)20(29)30)13-15-16-14(35-13)12-9(21(31)32)3-6(18(25)26)4-10(12)22(33)34/h1-4H