6-nitro-5-(phenylmethylsulfanyl)pyridin-3-amine

Systemtic Name: 6-nitro-5-(phenylmethylsulfanyl)pyridin-3-amine Openeye Name: 5-benzylsulfanyl-6-nitro-pyridin-3-amine CAS Name: 6-nitro-5-(phenylmethylthio)-3-pyridinamine IUPAC Name: 5-benzylsulfanyl-6-nitropyridin-3-amine Traditional Name: [5-(benzylthio)-6-nitro-3-pyridyl]amine Formula: C12H11N3O2S MolecularWeight: 261.29964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(N=CC(=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(N=CC(=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O2S/c13-10-6-11(12(14-7-10)15(16)17)18-8-9-4-2-1-3-5-9/h1-7H,8,13H2