Vitas-M small molecule compound
(2Z)-2-[3-methoxy-4-(2-methylpropoxy)benzylidene]-1-benzothiophen-3(2H)-one
Catalog ID
STK759840
SMILES COc1cc(ccc1OCC(C)C)/C=C/1\Sc2c(C1=O)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 C20H20O3S MW 340.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20O3S/c1-13(2)12-23-16-9-8-14(10-17(16)22-3)11-19-20(21)15-6-4-5-7-18(15)24-19/h4-11,13H,12H2,1-3H3/b19-11-InChIKey
YVYWYZWBJZDXLJ-ODLFYWEKSA-NSynonyms
(2Z)2((3METHOXY4(2METHYLPROPOXY)PHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(3methoxy4(2methylpropoxy)benzylidene)1benzothiophen3(2H)one
CC(C)COC1=C(C=C(C=C1)C=C2C(=O)C3=CC=CC=C3S2)OC
COc1cc(ccc1OCC(C)C)C=C1Sc2c(C1=O)cccc2
InChI=1SC20H20O3Sc113(2)1223169814(1017(16)223)111920(21)15645718(15)2419h41113H12H213H3b1911
MFCD01572865
ZINC000000077323
ZINC00077323
ZINC77323
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