5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]pyridin-2-amine

Systemtic Name: 5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]pyridin-2-amine Openeye Name: 5-[(2-methyl-3-nitro-phenyl)methylsulfanyl]pyridin-2-amine CAS Name: 5-[(2-methyl-3-nitrophenyl)methylthio]-2-pyridinamine IUPAC Name: 5-[(2-methyl-3-nitrophenyl)methylsulfanyl]pyridin-2-amine Traditional Name: [5-[(2-methyl-3-nitro-benzyl)thio]-2-pyridyl]amine Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=CN=C(C=C2)N

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=CN=C(C=C2)N

InChI

InChI=1S/C13H13N3O2S/c1-9-10(3-2-4-12(9)16(17)18)8-19-11-5-6-13(14)15-7-11/h2-7H,8H2,1H3,(H2,14,15)