5-(3,5-dinitrophenyl)-2,4-diphenyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(3,5-dinitrophenyl)-2,4-diphenyl-1,2,4-triazole-3-thione Openeye Name: 5-(3,5-dinitrophenyl)-2,4-diphenyl-1,2,4-triazole-3-thione CAS Name: 5-(3,5-dinitrophenyl)-2,4-diphenyl-1,2,4-triazole-3-thione IUPAC Name: 5-(3,5-dinitrophenyl)-2,4-diphenyl-1,2,4-triazole-3-thione Traditional Name: 5-(3,5-dinitrophenyl)-2,4-diphenyl-1,2,4-triazole-3-thione Formula: C20H13N5O4S MolecularWeight: 419.41332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN(C2=S)C3=CC=CC=C3)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN(C2=S)C3=CC=CC=C3)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H13N5O4S/c26-24(27)17-11-14(12-18(13-17)25(28)29)19-21-23(16-9-5-2-6-10-16)20(30)22(19)15-7-3-1-4-8-15/h1-13H