1-[2-(1H-benzimidazol-2-ylmethylsulfanyl)ethyl]-2-methyl-1-nitro-guanidine

Systemtic Name: 1-[2-(1H-benzimidazol-2-ylmethylsulfanyl)ethyl]-2-methyl-1-nitro-guanidine Openeye Name: 1-[2-(1H-benzimidazol-2-ylmethylsulfanyl)ethyl]-2-methyl-1-nitro-guanidine CAS Name: 1-[2-(1H-benzimidazol-2-ylmethylthio)ethyl]-2-methyl-1-nitroguanidine IUPAC Name: 1-[2-(1H-benzimidazol-2-ylmethylsulfanyl)ethyl]-2-methyl-1-nitroguanidine Traditional Name: 1-[2-(1H-benzimidazol-2-ylmethylthio)ethyl]-2-methyl-1-nitro-guanidine Formula: C12H16N6O2S MolecularWeight: 308.35944

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CCSCC1=NC2=CC=CC=C2N1)[N+](=O)[O-]

Isomeric SMILES

CN=C(N)N(CCSCC1=NC2=CC=CC=C2N1)[N+](=O)[O-]

InChI

InChI=1S/C12H16N6O2S/c1-14-12(13)17(18(19)20)6-7-21-8-11-15-9-4-2-3-5-10(9)16-11/h2-5H,6-8H2,1H3,(H2,13,14)(H,15,16)