Vitas-M small molecule compound
5,6-dimethoxy-2-{[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-2,3-dihydro-1H-inden-1-one
Catalog ID
STK648287
SMILES COc1cc2c(cc1OC)CC(C2=O)Sc1nnc(o1)c1ccccc1OC
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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 C20H18N2O5S MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S/c1-24-14-7-5-4-6-12(14)19-21-22-20(27-19)28-17-9-11-8-15(25-2)16(26-3)10-13(11)18(17)23/h4-8,10,17H,9H2,1-3H3InChIKey
CNLIXMADCBSXCJ-UHFFFAOYSA-NSynonyms
1144483-85-11144483851
56dimethoxy2((5(2methoxyphenyl)134oxadiazol2yl)sulfanyl)23dihydro1Hinden1one
56dimethoxy2((5(2methoxyphenyl)134oxadiazol2yl)sulfanyl)23dihydroinden1one
56dimethoxy2((5(2methoxyphenyl)134oxadiazol2yl)thio)23dihydro1Hinden1one
COC1=CC=CC=C1C2=NN=C(O2)SC3CC4=CC(=C(C=C4C3=O)OC)OC
InChI=1SC20H18N2O5Sc12414754612(14)19212220(2719)2817911815(252)16(263)1013(11)18(17)23h481017H9H213H3
MFCD12217297
ZINC000032103089
ZINC000032103091
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