5-(4-tert-butyl-2-methyl-phenyl)sulfanyl-1-methyl-4-nitro-imidazole

Systemtic Name: 5-(4-tert-butyl-2-methyl-phenyl)sulfanyl-1-methyl-4-nitro-imidazole Openeye Name: 5-(4-tert-butyl-2-methyl-phenyl)sulfanyl-1-methyl-4-nitro-imidazole CAS Name: 5-[(4-tert-butyl-2-methylphenyl)thio]-1-methyl-4-nitroimidazole IUPAC Name: 5-(4-tert-butyl-2-methylphenyl)sulfanyl-1-methyl-4-nitroimidazole Traditional Name: 5-[(4-tert-butyl-2-methyl-phenyl)thio]-1-methyl-4-nitro-imidazole Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)SC2=C(N=CN2C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)SC2=C(N=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O2S/c1-10-8-11(15(2,3)4)6-7-12(10)21-14-13(18(19)20)16-9-17(14)5/h6-9H,1-5H3