2-(4-nitrophenyl)-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 2-(4-nitrophenyl)-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 2-(4-nitrophenyl)-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 2-(4-nitrophenyl)-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 2-(4-nitrophenyl)-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 2-(4-nitrophenyl)-3-propyl-1H-1,2,4-triazole-5-thione Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=S)NN1C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NC(=S)NN1C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O2S/c1-2-3-10-12-11(18)13-14(10)8-4-6-9(7-5-8)15(16)17/h4-7H,2-3H2,1H3,(H,13,18)