Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanone
Catalog ID
STK354724
SMILES O=C(c1ccc2c(c1)OCCO2)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 C17H13N3O5S MW 371.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O5S/c21-14(10-1-4-15-16(7-10)25-6-5-24-15)9-26-17-18-12-3-2-11(20(22)23)8-13(12)19-17/h1-4,7-8H,5-6,9H2,(H,18,19)InChIKey
ZHWIYXLBCXMGQC-UHFFFAOYSA-NSynonyms
1043390-32-41(23dihydro14benzodioxin6yl)2((5nitro1Hbenzimidazol2yl)sulfanyl)ethanone
1(23dihydro14benzodioxin6yl)2((6nitro1Hbenzimidazol2yl)sulfanyl)ethanone
1(2H3HBENZO(34E)14DIOXIN6YL)2(5NITROBENZIMIDAZOL2YLTHIO)ETHAN1ONE
1043390324
C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC4=C(N3)C=C(C=C4)(N+)(=O)(O)
InChI=1SC17H13N3O5Sc2114(10141516(710)25652415)9261718123211(20(22)23)813(12)1917h1478H569H2(H1819)
MFCD11225452
O=C(c1ccc2c(c1)OCCO2)CSc1nc2c((nH)1)ccc(c2)(N+)(=O)(O)
ZINC000019074861
ZINC19074861
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