2-methyl-5-methylsulfanyl-4-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,2,4-triazole-3-thione

Systemtic Name: 2-methyl-5-methylsulfanyl-4-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,2,4-triazole-3-thione Openeye Name: 2-methyl-5-methylsulfanyl-4-[(E)-(5-nitro-2-furyl)methyleneamino]-1,2,4-triazole-3-thione CAS Name: 2-methyl-5-(methylthio)-4-[(E)-(5-nitro-2-furanyl)methylideneamino]-1,2,4-triazole-3-thione IUPAC Name: 2-methyl-5-methylsulfanyl-4-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,2,4-triazole-3-thione Traditional Name: 2-methyl-5-(methylthio)-4-[(E)-(5-nitro-2-furyl)methyleneamino]-1,2,4-triazole-3-thione Formula: C9H9N5O3S2 MolecularWeight: 299.32946

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)N(C(=N1)SC)N=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=S)N(C(=N1)SC)/N=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C9H9N5O3S2/c1-12-9(18)13(8(11-12)19-2)10-5-6-3-4-7(17-6)14(15)16/h3-5H,1-2H3/b10-5+