Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(4-methoxybenzyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide
Catalog ID
STK245455
SMILES COc1ccc(cc1)Cc1nnc(o1)SCC(=O)Nc1sc2c(c1C#N)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 C21H20N4O3S2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S2/c1-27-14-8-6-13(7-9-14)10-19-24-25-21(28-19)29-12-18(26)23-20-16(11-22)15-4-2-3-5-17(15)30-20/h6-9H,2-5,10,12H2,1H3,(H,23,26)InChIKey
DWOSVVWRJRGLGC-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)CC2=NN=C(O2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC21H20N4O3S2c127148613(7914)1019242521(2819)291218(26)232016(1122)15423517(15)3020h69H251012H21H3(H2326)
MFCD08669995
N(3cyano4567tetrahydro1benzothiophen2yl)2((5((4methoxyphenyl)methyl)134oxadiazol2yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((5(4methoxybenzyl)134oxadiazol2yl)sulfanyl)acetamide
ZINC000009306035
ZINC09306035
ZINC9306035
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