Vitas-M small molecule compound
{2-bromo-6-ethoxy-4-[(E)-(1-{2-[(2-methoxyphenyl)amino]-2-oxoethyl}-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
Catalog ID
STK199978
SMILES CCOc1cc(/C=C\2/NC(=O)N(C2=O)CC(=O)Nc2ccccc2OC)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 C23H22BrN3O8 MW 548.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O8/c1-3-34-18-10-13(8-14(24)21(18)35-12-20(29)30)9-16-22(31)27(23(32)26-16)11-19(28)25-15-6-4-5-7-17(15)33-2/h4-10H,3,11-12H2,1-2H3,(H,25,28)(H,26,32)(H,29,30)/b16-9+InChIKey
DCBIXZXTHZYVAJ-CXUHLZMHSA-NSynonyms
(2BROMO6ETHOXY4((E)(1(2((2METHOXYPHENYL)AMINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)ACETICACID
2(2bromo6ethoxy4((E)(1(2(2methoxyanilino)2oxoethyl)25dioxoimidazolidin4ylidene)methyl)phenoxy)aceticacid
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)N2)CC(=O)NC3=CC=CC=C3OC)Br)OCC(=O)O
CCOc1cc(C=C2NC(=O)N(C2=O)CC(=O)Nc2ccccc2OC)cc(c1OCC(=O)O)Br
InChI=1SC23H22BrN3O8c1334181013(814(24)21(18)351220(29)30)91622(31)27(23(32)2616)1119(28)2515645717(15)332h410H31112H212H3(H2528)(H2632)(H2930)b169+
MFCD08678302
ZINC000097961095
ZINC97961095
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