2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]pyridin-3-amine

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]pyridin-3-amine Openeye Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]pyridin-3-amine CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-3-pyridinamine IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]pyridin-3-amine Traditional Name: [2-[(4-methoxy-3-nitro-benzyl)thio]-3-pyridyl]amine Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=C(C=CC=N2)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=C(C=CC=N2)N)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O3S/c1-19-12-5-4-9(7-11(12)16(17)18)8-20-13-10(14)3-2-6-15-13/h2-7H,8,14H2,1H3