Vitas-M small molecule compound
2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-5-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-1,3,4-oxadiazole
Catalog ID
STK808209
SMILES O=S(=O)(c1cccc(c1)c1nnc(o1)SC/C=C/c1ccccc1)N1CCCC1
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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 C21H21N3O3S2 MW 427.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S2/c25-29(26,24-13-4-5-14-24)19-12-6-11-18(16-19)20-22-23-21(27-20)28-15-7-10-17-8-2-1-3-9-17/h1-3,6-12,16H,4-5,13-15H2/b10-7+InChIKey
KXKDILYVBWSEJW-JXMROGBWSA-NSynonyms
940999-52-0((3(5((2E)3PHENYLPROP2ENYLTHIO)134OXADIAZOL2YL)PHENYL)SULFONYL)PYRROLIDINE
2(((2E)3phenylprop2en1yl)sulfanyl)5(3(pyrrolidin1ylsulfonyl)phenyl)134oxadiazole
2((E)3phenylprop2enyl)sulfanyl5(3pyrrolidin1ylsulfonylphenyl)134oxadiazole
940999520
C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(O3)SCC=CC4=CC=CC=C4
InChI=1SC21H21N3O3S2c2529(262413451424)191261118(1619)20222321(2720)2815710178213917h1361216H451315H2b107+
MFCD09250134
O=S(=O)(c1cccc(c1)c1nnc(o1)SCC=Cc1ccccc1)N1CCCC1
ZINC000012374353
ZINC12374353
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