3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-3-ium

Systemtic Name: 3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-3-ium Openeye Name: 3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-3-ium CAS Name: 3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-3-ium IUPAC Name: 3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-3-ium Traditional Name: 3-(4-nitrophenyl)-5-phenyl-1,3,4-thiadiazol-3-ium Formula: C14H10N3O2S+ MolecularWeight: 284.3131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=N[N+](=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=N[N+](=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N3O2S/c18-17(19)13-8-6-12(7-9-13)16-10-20-14(15-16)11-4-2-1-3-5-11/h1-10H/q+1