3-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-indole

Systemtic Name: 3-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-indole Openeye Name: 3-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-indole CAS Name: 3-[[(1-methyl-2-imidazolyl)thio]methyl]-6-nitro-1H-indole IUPAC Name: 3-[(1-methylimidazol-2-yl)sulfanylmethyl]-6-nitro-1H-indole Traditional Name: 3-[[(1-methylimidazol-2-yl)thio]methyl]-6-nitro-1H-indole Formula: C13H12N4O2S MolecularWeight: 288.32498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CNC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SCC2=CNC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O2S/c1-16-5-4-14-13(16)20-8-9-7-15-12-6-10(17(18)19)2-3-11(9)12/h2-7,15H,8H2,1H3