Vitas-M small molecule compound
2-{[(5-nitro-1H-benzimidazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole
Catalog ID
STK045391
SMILES [O-][N+](=O)c1ccc2c(c1)nc([nH]2)CSc1nc2c(o1)cccc2
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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 C15H10N4O3S MW 326.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N4O3S/c20-19(21)9-5-6-10-12(7-9)17-14(16-10)8-23-15-18-11-3-1-2-4-13(11)22-15/h1-7H,8H2,(H,16,17)InChIKey
AKYRFPVYJQICLN-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)nc((nH)2)CSc1nc2c(o1)cccc2
2(((5NITRO1HBENZIMIDAZOL2YL)METHYL)SULFANYL)13BENZOXAZOLE
2((6NITRO1HBENZIMIDAZOL2YL)METHYLSULFANYL)13BENZOXAZOLE
2((6NITROBENZIMIDAZOL2YL)METHYLTHIO)BENZOXAZOLE
C1=CC=C2C(=C1)N=C(O2)SCC3=NC4=C(N3)C=C(C=C4)(N+)(=O)(O)
InChI=1SC15H10N4O3Sc2019(21)9561012(79)1714(1610)823151811312413(11)2215h17H8H2(H1617)
MFCD03571817
STK045391
ZINC000000304897
ZINC00304897
ZINC304897
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