Vitas-M small molecule compound
(2E)-2-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-1-benzothiophen-3(2H)-one
Catalog ID
STK756216
SMILES CCOc1cc(cc(c1O)I)/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 C17H13IO3S MW 424.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13IO3S/c1-2-21-13-8-10(7-12(18)17(13)20)9-15-16(19)11-5-3-4-6-14(11)22-15/h3-9,20H,2H2,1H3/b15-9+InChIKey
ALNMUJLEWQEVCM-OQLLNIDSSA-NSynonyms
(2E)2((3ETHOXY4HYDROXY5IODOPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2E)2(3ethoxy4hydroxy5iodobenzylidene)1benzothiophen3(2H)one
2((5ETHOXY4HYDROXY3IODOPHENYL)METHYLENE)BENZO(B)THIOPHEN3ONE
2(3ETHOXY4HYDROXY5IODOBENZYLIDENE)1BENZOTHIOPHEN3(2H)ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)I)O
CCOc1cc(cc(c1O)I)C=C1Sc2c(C1=O)cccc2
InChI=1SC17H13IO3Sc122113810(712(18)17(13)20)91516(19)11534614(11)2215h3920H2H21H3b159+
MFCD01029485
ZINC000000714034
ZINC00714034
ZINC714034
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