Vitas-M small molecule compound
2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Catalog ID
STK654902
SMILES COc1cc2c(cc1OC)CC(C2=O)Sc1nnc(o1)Cc1ccccc1
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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 C20H18N2O4S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4S/c1-24-15-9-13-10-17(19(23)14(13)11-16(15)25-2)27-20-22-21-18(26-20)8-12-6-4-3-5-7-12/h3-7,9,11,17H,8,10H2,1-2H3InChIKey
RRYMUTPFZSHUBB-UHFFFAOYSA-NSynonyms
1144444-68-71144444687
2((5benzyl134oxadiazol2yl)sulfanyl)56dimethoxy23dihydro1Hinden1one
2((5benzyl134oxadiazol2yl)sulfanyl)56dimethoxy23dihydroinden1one
2((5benzyl134oxadiazol2yl)thio)56dimethoxy23dihydro1Hinden1one
COC1=C(C=C2C(=C1)CC(C2=O)SC3=NN=C(O3)CC4=CC=CC=C4)OC
InChI=1SC20H18N2O4Sc124159131017(19(23)14(13)1116(15)252)2720222118(2620)8126435712h3791117H810H212H3
MFCD12216564
ZINC000032101417
ZINC000032101422
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