Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone
Catalog ID
STK055396
SMILES Cc1ccc2c(c1)nc([nH]2)SCC(=O)c1ccc2c(c1)OCO2
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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 C17H14N2O3S MW 326.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O3S/c1-10-2-4-12-13(6-10)19-17(18-12)23-8-14(20)11-3-5-15-16(7-11)22-9-21-15/h2-7H,8-9H2,1H3,(H,18,19)InChIKey
NUFRHDJPYYEIIB-UHFFFAOYSA-NSynonyms
1(13BENZODIOXOL5YL)2((5METHYL1HBENZIMIDAZOL2YL)SULFANYL)ETHANONE
1(13BENZODIOXOL5YL)2((6METHYL1HBENZIMIDAZOL2YL)SULFANYL)ETHANONE
1(benzo(d)(13)dioxol5yl)2((5methyl1Hbenzo(d)imidazol2yl)thio)ethanone
1BENZO(13)DIOXOL5YL2(5METHYL1HBENZOIMIDAZOL2YLSULFANYL)ETHANONE
CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CC4=C(C=C3)OCO4
Cc1ccc2c(c1)nc((nH)2)SCC(=O)c1ccc2c(c1)OCO2
InChI=1SC17H14N2O3Sc110241213(610)1917(1812)23814(20)11351516(711)2292115h27H89H21H3(H1819)
MFCD02238970
STK055396
ZINC000005687258
ZINC05687258
ZINC5687258
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