2-(ethylsulfonylmethyl)-3-methyl-5-nitro-4H-imidazole-5-carbonitrile

Systemtic Name: 2-(ethylsulfonylmethyl)-3-methyl-5-nitro-4H-imidazole-5-carbonitrile Openeye Name: 2-(ethylsulfonylmethyl)-3-methyl-5-nitro-4H-imidazole-5-carbonitrile CAS Name: 2-(ethylsulfonylmethyl)-3-methyl-5-nitro-4H-imidazole-5-carbonitrile IUPAC Name: 2-(ethylsulfonylmethyl)-3-methyl-5-nitro-4H-imidazole-5-carbonitrile Traditional Name: 2-(esylmethyl)-1-methyl-4-nitro-2-imidazoline-4-carbonitrile Formula: C8H12N4O4S MolecularWeight: 260.27028

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CC1=NC(CN1C)(C#N)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)CC1=NC(CN1C)(C#N)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O4S/c1-3-17(15,16)4-7-10-8(5-9,12(13)14)6-11(7)2/h3-4,6H2,1-2H3