Vitas-M small molecule compound
2-methyl-4-nitro-5-[(3-nitro-4-propoxybenzyl)sulfanyl]-1H-imidazole
Catalog ID
STK684628
SMILES CCCOc1ccc(cc1[N+](=O)[O-])CSc1[nH]c(nc1[N+](=O)[O-])C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C14H16N4O5S MW 352.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O5S/c1-3-6-23-12-5-4-10(7-11(12)17(19)20)8-24-14-13(18(21)22)15-9(2)16-14/h4-5,7H,3,6,8H2,1-2H3,(H,15,16)InChIKey
ZNZFETLIFMRYBL-UHFFFAOYSA-NSynonyms
2methyl4nitro5((3nitro4propoxybenzyl)sulfanyl)1Himidazole
2METHYL5NITRO4((3NITRO4PROPOXYPHENYL)METHYLSULFANYL)1HIMIDAZOLE
CCCOC1=C(C=C(C=C1)CSC2=C(NC(=N2)C)(N+)(=O)(O))(N+)(=O)(O)
CCCOc1ccc(cc1(N+)(=O)(O))CSc1(nH)c(nc1(N+)(=O)(O))C
InChI=1SC14H16N4O5Sc13623125410(711(12)17(19)20)8241413(18(21)22)159(2)1614h457H368H212H3(H1516)
MFCD03192808
ZINC000004628795
ZINC04628795
ZINC4628795
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