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

Systemtic Name: 5-(2-nitrophenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-benzyl-5-(2-nitrophenyl)-1H-1,2,4-triazole-3-thione CAS Name: 5-(2-nitrophenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-benzyl-5-(2-nitrophenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-benzyl-5-(2-nitrophenyl)-1H-1,2,4-triazole-3-thione Formula: C15H12N4O2S MolecularWeight: 312.34638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=S)N=C(N2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=S)N=C(N2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O2S/c20-19(21)13-9-5-4-8-12(13)14-16-15(22)18(17-14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17,22)