Vitas-M small molecule compound

[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetate

Catalog ID
STK922068
SMILES [O-]C(=O)CSc1nc2c([nH]1)ccc(c2)[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 C9H6N3O4S MW 252.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7N3O4S/c13-8(14)4-17-9-10-6-2-1-5(12(15)16)3-7(6)11-9/h1-3H,4H2,(H,10,11)(H,13,14)/p-1
InChIKey
SMTHPGGRKWIUEJ-UHFFFAOYSA-M
Synonyms

((5nitro1Hbenzimidazol2yl)sulfanyl)acetate
(O)C(=O)CSc1nc2c((nH)1)ccc(c2)(N+)(=O)(O)
2((6NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETATE
C1=CC2=C(C=C1(N+)(=O)(O))NC(=N2)SCC(=O)(O)
InChI=1SC9H7N3O4Sc138(14)4179106215(12(15)16)37(6)119h13H4H2(H1011)(H1314)p1
ZINC000005687395
ZINC05687395
ZINC19737068

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Available files

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