Vitas-M small molecule compound

1-[(4-butoxyphenyl)sulfonyl]-2-methyl-5-nitro-1H-imidazole

Catalog ID
STK353908
SMILES CCCCOc1ccc(cc1)S(=O)(=O)n1c(C)ncc1[N+](=O)[O-]

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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 C14H17N3O5S MW 339.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O5S/c1-3-4-9-22-12-5-7-13(8-6-12)23(20,21)16-11(2)15-10-14(16)17(18)19/h5-8,10H,3-4,9H2,1-2H3
InChIKey
YFBNTAGPEJAGDY-UHFFFAOYSA-N
Synonyms
325813-16-9
1((4butoxyphenyl)sulfonyl)2methyl5nitro1Himidazole
1((4BUTOXYPHENYL)SULFONYL)2METHYL5NITROIMIDAZOLE
1(4BUTOXYBENZENESULFONYL)2METHYL5NITRO1HIMIDAZOLE
1(4BUTOXYPHENYL)SULFONYL2METHYL5NITROIMIDAZOLE
325813169
CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C(=NC=C2(N+)(=O)(O))C
CCCCOc1ccc(cc1)S(=O)(=O)n1c(C)ncc1(N+)(=O)(O)
InChI=1SC14H17N3O5Sc134922125713(8612)23(2021)1611(2)151014(16)17(18)19h5810H349H212H3
MFCD01946736
ZINC000005690403
ZINC13370362
ZINC5690403

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Available files

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