Vitas-M small molecule compound
3-({2-chloro-6-methoxy-4-[(E)-(1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy}methyl)benzoic acid
Catalog ID
STK165317
SMILES COc1cc(/C=C\2/NC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCc1cccc(c1)C(=O)O)Cl
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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 C28H24ClN3O7 MW 549.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN3O7/c1-16-6-8-20(9-7-16)30-24(33)14-32-26(34)22(31-28(32)37)12-18-11-21(29)25(23(13-18)38-2)39-15-17-4-3-5-19(10-17)27(35)36/h3-13H,14-15H2,1-2H3,(H,30,33)(H,31,37)(H,35,36)/b22-12+InChIKey
IXIOOORROKFSNL-WSDLNYQXSA-NSynonyms
3((2CHLORO6METHOXY4((1((N(4METHYLPHENYL)CARBAMOYL)METHYL)25DIOXO(13DIAZOLIDIN4YLIDENE))METHYL)PHENOXY)METHYL)BENZOICACID
3((2CHLORO6METHOXY4((E)(1(2((4METHYLPHENYL)AMINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
3((2chloro6methoxy4((E)(1(2(4methylanilino)2oxoethyl)25dioxoimidazolidin4ylidene)methyl)phenoxy)methyl)benzoicacid
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC4=CC=CC(=C4)C(=O)O)OC)NC2=O
COc1cc(C=C2NC(=O)N(C2=O)CC(=O)Nc2ccc(cc2)C)cc(c1OCc1cccc(c1)C(=O)O)Cl
InChI=1SC28H24ClN3O7c1166820(9716)3024(33)143226(34)22(3128(32)37)12181121(29)25(23(1318)382)39151743519(1017)27(35)36h313H1415H212H3(H3033)(H3137)(H3536)b2212+
MFCD03270073
ZINC000100281818
ZINC100281818
Check stock
See real-time availability and sample size for STK165317 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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