Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide
Catalog ID
STK220109
SMILES O=C(Nc1ccc2c(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 C17H14N4O5S MW 386.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O5S/c22-16(18-10-1-4-14-15(7-10)26-6-5-25-14)9-27-17-19-12-3-2-11(21(23)24)8-13(12)20-17/h1-4,7-8H,5-6,9H2,(H,18,22)(H,19,20)InChIKey
LQQKOYMISPSFPT-UHFFFAOYSA-NSynonyms
694498-62-9694498629
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)(N+)(=O)(O)
InChI=1SC17H14N4O5Sc2216(1810141415(710)26652514)9271719123211(21(23)24)813(12)2017h1478H569H2(H1822)(H1920)
MFCD03910183
N(23DIHYDRO14BENZODIOXIN6YL)2((5NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
N(23DIHYDRO14BENZODIOXIN6YL)2((6NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
O=C(Nc1ccc2c(c1)OCCO2)CSc1nc2c((nH)1)ccc(c2)(N+)(=O)(O)
ZINC000004741876
ZINC01130655
ZINC04741876
ZINC4741876
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