2-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

Systemtic Name: 2-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: 2-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: 2-nitro-5-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: 2-nitro-5-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: [2-nitro-5-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C8H7N5O2S MolecularWeight: 237.23848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC2=NC=NN2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1SC2=NC=NN2)N)[N+](=O)[O-]

InChI

InChI=1S/C8H7N5O2S/c9-6-3-5(1-2-7(6)13(14)15)16-8-10-4-11-12-8/h1-4H,9H2,(H,10,11,12)