6-chloranyl-2-methyl-5-methylsulfonyl-7-nitro-1-propan-2-yl-benzimidazole

Systemtic Name: 6-chloranyl-2-methyl-5-methylsulfonyl-7-nitro-1-propan-2-yl-benzimidazole Openeye Name: 6-chloro-1-isopropyl-2-methyl-5-methylsulfonyl-7-nitro-benzimidazole CAS Name: 6-chloro-2-methyl-5-methylsulfonyl-7-nitro-1-propan-2-ylbenzimidazole IUPAC Name: 6-chloro-2-methyl-5-methylsulfonyl-7-nitro-1-propan-2-ylbenzimidazole Traditional Name: 6-chloro-1-isopropyl-5-mesyl-2-methyl-7-nitro-benzimidazole Formula: C12H14ClN3O4S MolecularWeight: 331.77526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C(=C2N1C(C)C)[N+](=O)[O-])Cl)S(=O)(=O)C

Isomeric SMILES

CC1=NC2=CC(=C(C(=C2N1C(C)C)[N+](=O)[O-])Cl)S(=O)(=O)C

InChI

InChI=1S/C12H14ClN3O4S/c1-6(2)15-7(3)14-8-5-9(21(4,19)20)10(13)12(11(8)15)16(17)18/h5-6H,1-4H3