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4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole

4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole

Systemtic Name:4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole
Openeye Name:4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole
CAS Name:4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitroimidazole
IUPAC Name:4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitroimidazole
Traditional Name:4-[(4-chlorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole
Formula: C12H12ClN3O4S
MolecularWeight: 329.75938
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1C)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)Cl


Isomeric SMILES

CC1=NC(=C(N1C)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)Cl


InChI

InChI=1S/C12H12ClN3O4S/c1-8-14-11(12(15(8)2)16(17)18)7-21(19,20)10-5-3-9(13)4-6-10/h3-6H,7H2,1-2H3


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