2-(azidomethyl)-1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazole

Systemtic Name: 2-(azidomethyl)-1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazole Openeye Name: 2-(azidomethyl)-4-isopropyl-1-methyl-5-(3-nitrophenyl)sulfanyl-imidazole CAS Name: 2-(azidomethyl)-1-methyl-5-[(3-nitrophenyl)thio]-4-propan-2-ylimidazole IUPAC Name: 2-(azidomethyl)-1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-ylimidazole Traditional Name: 2-(azidomethyl)-4-isopropyl-1-methyl-5-[(3-nitrophenyl)thio]imidazole Formula: C14H16N6O2S MolecularWeight: 332.38084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CN=[N+]=[N-])C)SC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CN=[N+]=[N-])C)SC2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O2S/c1-9(2)13-14(19(3)12(17-13)8-16-18-15)23-11-6-4-5-10(7-11)20(21)22/h4-7,9H,8H2,1-3H3