Vitas-M small molecule compound
{2-bromo-6-ethoxy-4-[(E)-(3-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STK153353
SMILES CCOc1cc(/C=C\2/SC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCC(=O)O)Br
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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 C23H21BrN2O7S MW 549.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN2O7S/c1-3-32-17-9-14(8-16(24)21(17)33-12-20(28)29)10-18-22(30)26(23(31)34-18)11-19(27)25-15-6-4-13(2)5-7-15/h4-10H,3,11-12H2,1-2H3,(H,25,27)(H,28,29)/b18-10+InChIKey
OJZJXYWFSPZNCE-VCHYOVAHSA-NSynonyms
757224-30-9(2BROMO6ETHOXY4((E)(3(2((4METHYLPHENYL)AMINO)2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETICACID
2(2bromo6ethoxy4((E)(3(2(4methylanilino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)aceticacid
757224309
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=C(C=C3)C)Br)OCC(=O)O
CCOc1cc(C=C2SC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCC(=O)O)Br
InChI=1SC23H21BrN2O7Sc133217914(816(24)21(17)331220(28)29)101822(30)26(23(31)3418)1119(27)25156413(2)5715h410H31112H212H3(H2527)(H2829)b1810+
MFCD03181756
ZINC000100275669
ZINC100275669
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