2-nitro-4-(phenylmethylsulfanyl)pyridin-3-amine

Systemtic Name: 2-nitro-4-(phenylmethylsulfanyl)pyridin-3-amine Openeye Name: 4-benzylsulfanyl-2-nitro-pyridin-3-amine CAS Name: 2-nitro-4-(phenylmethylthio)-3-pyridinamine IUPAC Name: 4-benzylsulfanyl-2-nitropyridin-3-amine Traditional Name: [4-(benzylthio)-2-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(C(=NC=C2)[N+](=O)[O-])N

Isomeric SMILES

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

InChI

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