Vitas-M small molecule compound
{2-[(E)-{3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetic acid
Catalog ID
STK114366
SMILES OC(=O)COc1ccccc1/C=C\1/SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
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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 C20H14ClNO7S MW 447.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClNO7S/c21-13-7-16-15(28-10-29-16)5-12(13)8-22-19(25)17(30-20(22)26)6-11-3-1-2-4-14(11)27-9-18(23)24/h1-7H,8-10H2,(H,23,24)/b17-6+InChIKey
IGCVTRDZWVUZSH-UBKPWBPPSA-NSynonyms
(2((E)(3((6CHLORO13BENZODIOXOL5YL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETICACID
2(2((E)(3((6chloro13benzodioxol5yl)methyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)aceticacid
C1OC2=C(O1)C=C(C(=C2)CN3C(=O)C(=CC4=CC=CC=C4OCC(=O)O)SC3=O)Cl
InChI=1SC20H14ClNO7Sc211371615(28102916)512(13)82219(25)17(3020(22)26)611312414(11)27918(23)24h17H810H2(H2324)b176+
MFCD07546756
OC(=O)COc1ccccc1C=C1SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl
ZINC000012628542
ZINC12628542
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