1-methyl-2-nitro-1-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethyl]guanidine

Systemtic Name: 1-methyl-2-nitro-1-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethyl]guanidine Openeye Name: 1-[2-(isoxazol-3-ylmethylsulfanyl)ethyl]-1-methyl-2-nitro-guanidine CAS Name: 1-[2-(3-isoxazolylmethylthio)ethyl]-1-methyl-2-nitroguanidine IUPAC Name: 1-methyl-2-nitro-1-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethyl]guanidine Traditional Name: 1-[2-(isoxazol-3-ylmethylthio)ethyl]-1-methyl-2-nitro-guanidine Formula: C8H13N5O3S MolecularWeight: 259.28552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCSCC1=NOC=C1)C(=N[N+](=O)[O-])N

Isomeric SMILES

CN(CCSCC1=NOC=C1)/C(=N\[N+](=O)[O-])/N

InChI

InChI=1S/C8H13N5O3S/c1-12(8(9)10-13(14)15)3-5-17-6-7-2-4-16-11-7/h2,4H,3,5-6H2,1H3,(H2,9,10)