Vitas-M small molecule compound
ethyl 3-[({[5-({[(4-methoxyphenyl)acetyl]amino}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK129661
SMILES CCOC(=O)c1cccc(c1)NC(=O)CSc1nnc(n1C)CNC(=O)Cc1ccc(cc1)OC
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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 C24H27N5O5S MW 497.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O5S/c1-4-34-23(32)17-6-5-7-18(13-17)26-22(31)15-35-24-28-27-20(29(24)2)14-25-21(30)12-16-8-10-19(33-3)11-9-16/h5-11,13H,4,12,14-15H2,1-3H3,(H,25,30)(H,26,31)InChIKey
MYMXAAKFPYHPFY-UHFFFAOYSA-NSynonyms
3(2(5((2(4METHOXYPHENYL)ACETYLAMINO)METHYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACIDETHYLESTER
CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C)CNC(=O)CC3=CC=C(C=C3)OC
ETHYL3((((5((((4METHOXYPHENYL)ACETYL)AMINO)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL3((2((5(((2(4METHOXYPHENYL)ACETYL)AMINO)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC24H27N5O5Sc143423(32)1765718(1317)2622(31)153524282720(29(24)2)142521(30)121681019(333)11916h51113H4121415H213H3(H2530)(H2631)
MFCD04374536
ZINC000009260974
ZINC09260974
ZINC9260974
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