Vitas-M small molecule compound
1-(3,3-dimethyl-2-oxobutyl)-4-{5-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-1,3,4-oxadiazol-2-yl}pyridinium
Catalog ID
STK955050
SMILES O=C(C(C)(C)C)CSc1nnc(o1)c1cc[n+](cc1)CC(=O)C(C)(C)C
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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 C19H26N3O3S MW 376.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N3O3S/c1-18(2,3)14(23)11-22-9-7-13(8-10-22)16-20-21-17(25-16)26-12-15(24)19(4,5)6/h7-10H,11-12H2,1-6H3/q+1InChIKey
QPIVJCMKHASBMS-UHFFFAOYSA-NSynonyms
1(33dimethyl2oxobutyl)4(5((33dimethyl2oxobutyl)sulfanyl)134oxadiazol2yl)pyridinium
1(33dimethyl2oxobutyl)4(5((33dimethyl2oxobutyl)thio)134oxadiazol2yl)pyridin1iumbromide
1(4(5(33DIMETHYL2OXOBUTYL)SULFANYL134OXADIAZOL2YL)PYRIDIN1IUM1YL)33DIMETHYLBUTAN2ONE
1(4(5(33DIMETHYL2OXOBUTYLTHIO)(134OXADIAZOL2YL))PYRIDYL)33DIMETHYLBUTAN2ONE
CC(C)(C)C(=O)C(N+)1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)C(C)(C)C
InChI=1SC19H26N3O3Sc118(23)14(23)11229713(81022)16202117(2516)261215(24)19(45)6h710H1112H216H3q+1
O=C(C(C)(C)C)CSc1nnc(o1)c1cc(n+)(cc1)CC(=O)C(C)(C)C
O=C(C(C)(C)C)CSc1nnc(o1)c1cc(n+)(cc1)CC(=O)C(C)(C)C(Br)
ZINC01822442
ZINC1822442
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