2-[(4-methylphenyl)sulfanylmethyl]-5-nitro-furan

Systemtic Name: 2-[(4-methylphenyl)sulfanylmethyl]-5-nitro-furan Openeye Name: 2-nitro-5-(p-tolylsulfanylmethyl)furan CAS Name: 2-[[(4-methylphenyl)thio]methyl]-5-nitrofuran IUPAC Name: 2-[(4-methylphenyl)sulfanylmethyl]-5-nitrofuran Traditional Name: 2-nitro-5-[(p-tolylthio)methyl]furan Formula: C12H11NO3S MolecularWeight: 249.28564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO3S/c1-9-2-5-11(6-3-9)17-8-10-4-7-12(16-10)13(14)15/h2-7H,8H2,1H3