2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]ethanamine

Systemtic Name: 2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]ethanamine Openeye Name: 2-[(2-methyl-3-nitro-phenyl)methylsulfanyl]ethanamine CAS Name: 2-[(2-methyl-3-nitrophenyl)methylthio]ethanamine IUPAC Name: 2-[(2-methyl-3-nitrophenyl)methylsulfanyl]ethanamine Traditional Name: 2-[(2-methyl-3-nitro-benzyl)thio]ethylamine Formula: C10H14N2O2S MolecularWeight: 226.29536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSCCN

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSCCN

InChI

InChI=1S/C10H14N2O2S/c1-8-9(7-15-6-5-11)3-2-4-10(8)12(13)14/h2-4H,5-7,11H2,1H3