Vitas-M small molecule compound
2-chloro-5-{5-[(E)-{3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]furan-2-yl}benzoic acid
Catalog ID
STK327248
SMILES O=C1S/C(=C/c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C(=O)N1Cc1cc2OCOc2cc1Cl
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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 C23H13Cl2NO7S MW 518.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13Cl2NO7S/c24-15-3-1-11(5-14(15)22(28)29)17-4-2-13(33-17)7-20-21(27)26(23(30)34-20)9-12-6-18-19(8-16(12)25)32-10-31-18/h1-8H,9-10H2,(H,28,29)/b20-7+InChIKey
YDTUKYYSQQCKII-IFRROFPPSA-NSynonyms
2CHLORO5(5((E)(3((6CHLORO13BENZODIOXOL5YL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
C1OC2=C(O1)C=C(C(=C2)CN3C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)C(=O)O)SC3=O)Cl
InChI=1SC23H13Cl2NO7Sc24153111(514(15)22(28)29)174213(3317)72021(27)26(23(30)3420)91261819(816(12)25)32103118h18H910H2(H2829)b207+
MFCD03614468
O=C1SC(=Cc2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)C(=O)N1Cc1cc2OCOc2cc1Cl
ZINC000097962587
ZINC97962587
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