Vitas-M small molecule compound
ethyl [(5-{1-[(tert-butoxycarbonyl)amino]-2-methylbutyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
Catalog ID
STL348998
SMILES CCOC(=O)CSc1nnc(o1)C(C(CC)C)NC(=O)OC(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 C16H27N3O5S MW 373.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H27N3O5S/c1-7-10(3)12(17-14(21)24-16(4,5)6)13-18-19-15(23-13)25-9-11(20)22-8-2/h10,12H,7-9H2,1-6H3,(H,17,21)InChIKey
PJGVGZCDEGQJOM-UHFFFAOYSA-NSynonyms
CCC(C)C(C1=NN=C(O1)SCC(=O)OCC)NC(=O)OC(C)(C)C
CCOC(=O)CSc1nnc(o1)(C@H)(C(CC)C)NC(=O)OC(C)(C)C
ethyl((5(1((tertbutoxycarbonyl)amino)2methylbutyl)134oxadiazol2yl)sulfanyl)acetate
ethyl2((5((1S2R)1((tertbutoxycarbonyl)amino)2methylbutyl)134oxadiazol2yl)thio)acetate
ETHYL2((5(2METHYL1((2METHYLPROPAN2YL)OXYCARBONYLAMINO)BUTYL)134OXADIAZOL2YL)SULFANYL)ACETATE
InChI=1SC16H27N3O5Sc1710(3)12(1714(21)2416(45)6)13181915(2313)25911(20)2282h1012H79H216H3(H1721)
MFCD28032614
ZINC000005555524
ZINC000016007174
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