Vitas-M small molecule compound
methyl [({[5-(4-hydroxybenzyl)-4-methyl-1H-imidazol-2-yl]sulfanyl}acetyl)amino](phenyl)acetate
Catalog ID
STK783773
SMILES COC(=O)C(c1ccccc1)NC(=O)CSc1nc(c([nH]1)Cc1ccc(cc1)O)C
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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 C22H23N3O4S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4S/c1-14-18(12-15-8-10-17(26)11-9-15)24-22(23-14)30-13-19(27)25-20(21(28)29-2)16-6-4-3-5-7-16/h3-11,20,26H,12-13H2,1-2H3,(H,23,24)(H,25,27)InChIKey
KOGNIHFTQKTBPJ-UHFFFAOYSA-NSynonyms
CC1=C(N=C(N1)SCC(=O)NC(C2=CC=CC=C2)C(=O)OC)CC3=CC=C(C=C3)O
COC(=O)C(c1ccccc1)NC(=O)CSc1nc(c((nH)1)Cc1ccc(cc1)O)C
InChI=1SC22H23N3O4Sc11418(121581017(26)11915)2422(2314)301319(27)2520(21(28)292)166435716h3112026H1213H212H3(H2324)(H2527)
methyl((((5(4hydroxybenzyl)4methyl1Himidazol2yl)sulfanyl)acetyl)amino)(phenyl)acetate
METHYL2((2((4((4HYDROXYPHENYL)METHYL)5METHYL1HIMIDAZOL2YL)SULFANYL)ACETYL)AMINO)2PHENYLACETATE
METHYL2(2(5((4HYDROXYPHENYL)METHYL)4METHYLIMIDAZOL2YLTHIO)ACETYLAMINO)2PHENYLACETATE
MFCD06618921
ZINC000012372043
ZINC000012372044
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