1-methyl-3-[(4-nitrophenyl)methyl]imidazole-2-thione

Systemtic Name: 1-methyl-3-[(4-nitrophenyl)methyl]imidazole-2-thione Openeye Name: 1-methyl-3-[(4-nitrophenyl)methyl]imidazole-2-thione CAS Name: 1-methyl-3-[(4-nitrophenyl)methyl]-2-imidazolethione IUPAC Name: 1-methyl-3-[(4-nitrophenyl)methyl]imidazole-2-thione Traditional Name: 1-methyl-3-(4-nitrobenzyl)-4-imidazoline-2-thione Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN(C1=S)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN(C1=S)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O2S/c1-12-6-7-13(11(12)17)8-9-2-4-10(5-3-9)14(15)16/h2-7H,8H2,1H3