1-ethyl-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzimidazole

Systemtic Name: 1-ethyl-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzimidazole Openeye Name: 1-ethyl-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzimidazole CAS Name: 1-ethyl-2-[(4-methylsulfonyl-2-nitrophenyl)thio]benzimidazole IUPAC Name: 1-ethyl-2-(4-methylsulfonyl-2-nitrophenyl)sulfanylbenzimidazole Traditional Name: 1-ethyl-2-[(4-mesyl-2-nitro-phenyl)thio]benzimidazole Formula: C16H15N3O4S2 MolecularWeight: 377.438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S2/c1-3-18-13-7-5-4-6-12(13)17-16(18)24-15-9-8-11(25(2,22)23)10-14(15)19(20)21/h4-10H,3H2,1-2H3