Vitas-M small molecule compound
5,6-dimethoxy-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-2,3-dihydro-1H-inden-1-one
Catalog ID
STK651310
SMILES COc1cc(cc(c1OC)OC)c1nnc(o1)SC1Cc2c(C1=O)cc(c(c2)OC)OC
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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 C22H22N2O7S MW 458.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O7S/c1-26-14-6-11-9-18(19(25)13(11)10-15(14)27-2)32-22-24-23-21(31-22)12-7-16(28-3)20(30-5)17(8-12)29-4/h6-8,10,18H,9H2,1-5H3InChIKey
AUFBPSXVKRVDGQ-UHFFFAOYSA-NSynonyms
1144474-57-61144474576
56dimethoxy2((5(345trimethoxyphenyl)134oxadiazol2yl)sulfanyl)23dihydro1Hinden1one
56dimethoxy2((5(345trimethoxyphenyl)134oxadiazol2yl)sulfanyl)23dihydroinden1one
56dimethoxy2((5(345trimethoxyphenyl)134oxadiazol2yl)thio)23dihydro1Hinden1one
COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SC3CC4=CC(=C(C=C4C3=O)OC)OC
InChI=1SC22H22N2O7Sc12614611918(19(25)13(11)1015(14)272)3222242321(3122)12716(283)20(305)17(812)294h681018H9H215H3
MFCD12212635
ZINC000032087536
ZINC000032087540
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