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

Systemtic Name: 5-nitro-4-(phenylmethylsulfanyl)pyridin-2-amine Openeye Name: 4-benzylsulfanyl-5-nitro-pyridin-2-amine CAS Name: 5-nitro-4-(phenylmethylthio)-2-pyridinamine IUPAC Name: 4-benzylsulfanyl-5-nitropyridin-2-amine Traditional Name: [4-(benzylthio)-5-nitro-2-pyridyl]amine Formula: C12H11N3O2S MolecularWeight: 261.29964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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