4-methyl-3-(4-nitrophenyl)-1-propan-2-yl-imidazole-2-thione

Systemtic Name: 4-methyl-3-(4-nitrophenyl)-1-propan-2-yl-imidazole-2-thione Openeye Name: 1-isopropyl-4-methyl-3-(4-nitrophenyl)imidazole-2-thione CAS Name: 4-methyl-3-(4-nitrophenyl)-1-propan-2-yl-2-imidazolethione IUPAC Name: 4-methyl-3-(4-nitrophenyl)-1-propan-2-ylimidazole-2-thione Traditional Name: 1-isopropyl-4-methyl-3-(4-nitrophenyl)-4-imidazoline-2-thione Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=S)N1C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=CN(C(=S)N1C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C13H15N3O2S/c1-9(2)14-8-10(3)15(13(14)19)11-4-6-12(7-5-11)16(17)18/h4-9H,1-3H3